data_2kzj_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 2kzj _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 ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -61.68 -40.01 93.44 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.406 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 12.6 mtt -66.0 -39.56 90.38 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.753 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -58.01 -45.1 87.44 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.502 0.501 . . . . 0.0 110.742 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.43 -51.31 68.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.91 68.26 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.109 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.98 -64.89 0.78 Allowed 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.796 0.331 . . . . 0.0 110.769 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -71.06 -36.23 72.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.91 -40.73 81.09 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.995 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.67 -44.73 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.89 64.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.157 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.15 -37.63 80.69 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.938 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -66.02 120.87 72.86 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 120.32 -0.552 . . . . 0.0 109.877 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.37 -7.89 5.66 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.665 2.91 . . . . 0.0 115.78 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -99.18 -2.17 37.46 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.454 ' HA ' HE22 ' A' ' 55' ' ' GLN . 32.4 mt -74.51 133.26 42.32 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.314 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.463 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -53.09 146.8 10.68 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.067 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -51.96 -40.7 61.28 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -68.24 -42.51 79.61 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.95 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.463 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.17 -43.37 95.35 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.716 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -57.15 -48.0 79.77 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.54 0.21 . . . . 0.0 111.16 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.31 -35.85 68.74 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.62 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.14 -56.77 17.91 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -59.95 -45.81 91.43 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.796 -0.361 . . . . 0.0 111.947 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.444 HD11 HG22 ' A' ' 31' ' ' ILE . 44.8 mt -58.6 -38.66 72.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.664 179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -74.24 -32.53 63.01 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -58.23 -33.22 69.11 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.842 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -52.64 -50.27 63.5 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -63.27 -39.19 93.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.112 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.28 -38.28 79.77 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.701 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.46 84.53 2.55 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 120.859 0.361 . . . . 0.0 110.728 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.07 -25.22 44.1 Favored 'Trans proline' 0 N--CA 1.502 1.976 0 C-N-CA 122.834 2.356 . . . . 0.0 112.631 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.6 p -60.41 -30.91 69.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.556 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -92.08 8.83 36.0 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.171 0.295 . . . . 0.0 111.767 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.0 p -43.65 -50.86 7.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.45 92.95 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.322 0.389 . . . . 0.0 110.895 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -70.37 -49.62 47.31 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -57.0 -44.82 83.17 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.319 0.387 . . . . 0.0 111.054 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.9 tp -60.2 -48.64 80.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.96 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.81 -43.37 98.99 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -61.22 -38.89 88.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.939 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.92 88.4 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -63.1 -32.42 73.79 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.943 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -60.77 -43.66 97.75 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.84 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.82 -39.67 95.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.802 178.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -63.42 -49.83 72.21 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.093 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.56 -38.57 90.57 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.21 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -51.55 15.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.454 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.9 mt-30 -65.83 -27.27 68.12 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.28 145.33 57.74 Favored Pre-proline 0 CA--C 1.54 0.558 0 O-C-N 123.144 0.278 . . . . 0.0 111.277 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.39 170.03 5.83 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.515 2.144 . . . . 0.0 111.805 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 CA--C 1.547 0.864 0 CA-C-O 117.565 -1.207 . . . . 0.0 110.606 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 111.359 0.133 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.91 -40.52 96.67 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 121.09 -0.244 . . . . 0.0 110.655 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtm -62.14 -46.14 90.31 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.284 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -58.11 -39.72 79.35 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.507 0.505 . . . . 0.0 110.986 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -60.53 -57.56 12.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.153 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.35 68.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -55.24 -58.77 6.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.202 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -71.09 -38.77 72.39 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -60.18 -43.13 96.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.962 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 87.7 mt -65.19 -47.53 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -30.85 68.2 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -59.51 -35.95 75.13 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.531 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mp -67.06 120.34 71.24 Favored Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -88.38 -26.23 0.64 Allowed 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.752 2.968 . . . . 0.0 116.247 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -84.66 -0.22 52.68 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.47 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.4 mt -73.5 132.91 43.42 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.525 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.472 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -50.62 145.49 6.68 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.815 0.697 . . . . 0.0 109.781 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -50.49 -40.3 50.69 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.36 -41.43 85.11 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.686 0.279 . . . . 0.0 111.004 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.472 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -65.23 -39.56 92.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.933 -179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -55.3 -53.75 52.21 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.646 0.26 . . . . 0.0 111.459 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -72.69 -34.03 66.9 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.432 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.68 -59.62 5.09 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -59.0 -47.04 86.62 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 57.1 mt -59.78 -37.32 70.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.214 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -69.72 -37.89 76.71 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.7 m -58.94 -32.86 69.98 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.613 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -51.22 -56.59 12.08 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 120.788 0.328 . . . . 0.0 110.299 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -62.68 -38.62 91.08 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.179 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.96 -36.54 72.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.993 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -161.98 82.9 1.75 Allowed Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 120.647 0.261 . . . . 0.0 111.106 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -56.81 -19.16 30.1 Favored 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.81 2.34 . . . . 0.0 112.919 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 t -57.42 -34.5 68.99 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.095 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -104.86 18.08 22.97 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.105 0.253 . . . . 0.0 111.071 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.8 p -50.82 -39.01 52.13 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -38.98 92.8 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.1 0.476 . . . . 0.0 109.934 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -68.59 -46.31 69.7 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.135 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.9 mt -57.35 -45.71 84.07 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.352 0.408 . . . . 0.0 111.289 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 tp -60.49 -49.38 77.8 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.58 95.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.823 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -64.05 -39.59 94.42 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.654 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.05 95.42 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -64.85 -37.46 87.69 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.398 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -59.6 -43.25 93.77 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.219 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.1 mt -63.18 -43.06 99.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.949 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -61.51 -48.24 81.96 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.261 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.35 -38.4 86.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.506 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.53 -51.52 11.54 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.47 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.0 mt-30 -66.3 -27.86 68.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.93 144.81 56.41 Favored Pre-proline 0 CA--C 1.539 0.529 0 O-C-N 123.157 0.286 . . . . 0.0 111.593 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.31 153.58 50.84 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 122.982 2.454 . . . . 0.0 112.326 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.418 179.817 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.66 -34.34 72.7 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.1 0.476 . . . . 0.0 109.989 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -43.64 97.14 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.949 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.98 -39.23 88.83 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.979 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -61.46 -55.94 25.63 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.846 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.65 74.26 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -55.69 -59.72 4.45 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.622 0.248 . . . . 0.0 111.34 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -71.08 -38.09 72.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.166 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.23 -41.65 89.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.802 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.76 -48.97 80.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.73 -30.6 67.6 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.0 tp -60.33 -36.27 77.56 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.663 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -64.42 120.69 67.35 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -87.83 -27.72 0.52 Allowed 'Trans proline' 0 N--CA 1.504 2.107 0 C-N-CA 123.765 2.977 . . . . 0.0 116.271 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -83.89 -0.5 51.55 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.467 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -72.94 135.98 45.11 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.373 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.476 ' H ' HE21 ' A' ' 26' ' ' GLN . 81.2 m-20 -55.11 144.94 22.25 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.537 0.523 . . . . 0.0 109.973 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -49.66 -41.51 43.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -66.16 -41.42 90.37 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.149 0.281 . . . . 0.0 110.912 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.476 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.7 mt-30 -65.44 -40.3 93.1 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.047 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -55.69 -53.18 59.68 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.738 0.304 . . . . 0.0 111.235 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -70.41 -36.78 74.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.204 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.93 -58.37 8.83 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -58.64 -47.05 85.73 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -61.04 -37.95 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.431 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.6 ttt-85 -68.51 -41.86 79.39 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.4 m -58.97 -34.52 71.9 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.995 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -44.27 78.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.254 0.346 . . . . 0.0 110.543 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -66.94 -42.67 84.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.117 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.95 -39.54 90.54 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.033 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -137.09 77.27 43.23 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.179 0.3 . . . . 0.0 110.465 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.17 -24.27 78.81 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.355 2.036 . . . . 0.0 112.266 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.7 p -61.76 -30.53 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.332 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -90.68 5.27 48.79 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 123.27 0.356 . . . . 0.0 110.905 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 p -40.15 -53.96 2.38 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.87 92.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.277 0.361 . . . . 0.0 110.972 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -67.76 -47.11 70.14 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.184 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.7 mt -58.44 -40.84 83.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.258 0.349 . . . . 0.0 111.046 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.2 tp -61.76 -48.09 82.25 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.07 -43.12 99.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.704 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -62.21 -38.98 91.23 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.682 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.28 96.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -63.45 -36.65 84.46 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.555 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -59.2 -43.89 92.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.377 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.91 -43.81 97.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.029 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.35 -47.99 83.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -61.78 -38.35 87.73 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.533 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.43 -50.93 12.87 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.467 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.9 mt-30 -66.02 -27.85 68.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.18 144.82 58.9 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.192 0.308 . . . . 0.0 111.64 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.2 167.98 8.4 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 122.649 2.233 . . . . 0.0 112.021 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 CA--C 1.547 0.843 0 CA-C-O 117.436 -1.269 . . . . 0.0 110.762 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.2 tptt . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -62.32 -37.54 85.97 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.469 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.54 -41.76 98.44 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.372 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.89 -39.1 87.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.418 0.449 . . . . 0.0 110.35 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -59.81 -54.84 41.54 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.772 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.9 70.36 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.167 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -54.76 -57.84 9.93 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.692 0.282 . . . . 0.0 111.232 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -69.24 -39.9 78.23 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.83 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -60.92 -40.5 93.4 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.122 0.263 . . . . 0.0 111.111 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 71.6 mt -64.7 -52.08 59.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.33 -29.07 68.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.393 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.18 -32.88 71.49 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.473 0.483 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.34 136.82 75.73 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.186 -178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -90.47 -42.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 123.597 2.864 . . . . 0.0 116.592 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.86 -0.48 57.59 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.457 ' HA ' HE22 ' A' ' 55' ' ' GLN . 95.9 mt -65.48 137.82 57.69 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.672 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.512 ' H ' HE21 ' A' ' 26' ' ' GLN . 65.2 t30 -57.64 157.79 6.76 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -53.01 -51.28 62.17 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.12 -41.02 74.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.512 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.6 mt-30 -59.41 -42.47 91.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -59.78 -50.58 73.27 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.062 0.226 . . . . 0.0 111.003 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 -71.8 -32.08 67.24 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.414 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.02 -47.08 87.32 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -59.64 -53.11 61.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.89 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.0 mt -59.01 -39.87 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 122.977 0.173 . . . . 0.0 110.582 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.4 -43.95 92.79 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 120.968 0.413 . . . . 0.0 109.973 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.4 m -60.67 -32.68 71.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.82 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -46.97 76.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.097 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -64.59 -42.45 95.58 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.482 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.16 -36.9 81.05 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.49 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -151.51 88.41 4.32 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.587 0.232 . . . . 0.0 111.159 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -54.33 -24.92 36.74 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.755 2.303 . . . . 0.0 112.517 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -58.9 -33.6 70.72 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.449 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -86.35 1.23 51.91 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.7 p -40.03 -56.23 1.9 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.78 92.52 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.48 -47.47 66.99 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.594 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 36.8 mt -57.98 -41.5 83.12 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.408 0.443 . . . . 0.0 110.859 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.59 -50.76 71.32 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.89 83.22 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.023 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -61.76 -33.36 73.94 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.596 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -43.79 91.35 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -62.5 -36.41 82.44 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.197 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -63.35 -50.6 69.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.69 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.88 -41.98 99.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.463 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -60.65 -47.47 86.1 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.216 0.322 . . . . 0.0 110.389 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.95 -38.52 91.38 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.114 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.44 -51.42 13.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.457 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.9 mt-30 -66.0 -27.99 68.54 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.77 146.46 66.49 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 123.133 0.271 . . . . 0.0 111.131 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.74 159.93 50.52 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.881 2.387 . . . . 0.0 112.047 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.471 0.624 0 O-C-N 124.018 0.824 . . . . 0.0 110.932 -179.922 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp . . . . . 0 C--O 1.237 0.441 0 CA-C-O 121.074 0.464 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -63.55 -35.95 82.18 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.123 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.2 mtt -61.69 -40.82 96.36 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.854 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -62.08 -42.65 99.43 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.395 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -59.66 -50.93 71.97 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.731 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.42 -29.71 67.5 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.002 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -56.9 -55.02 39.93 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.518 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -75.3 -36.19 61.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.86 -47.51 83.06 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.94 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.96 -50.39 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.267 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -30.66 64.89 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.543 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -60.13 -36.76 78.22 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.402 0.439 . . . . 0.0 111.822 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.32 119.9 57.15 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -87.71 -22.18 1.6 Allowed 'Trans proline' 0 N--CA 1.503 2.063 0 C-N-CA 123.569 2.846 . . . . 0.0 115.516 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.496 HD22 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -82.62 -6.1 59.17 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.473 ' HA ' HE22 ' A' ' 55' ' ' GLN . 18.9 mt -72.99 131.53 42.27 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.662 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.509 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.5 t-20 -53.2 146.83 10.97 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.965 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -51.76 -41.44 61.61 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.0 -41.93 81.51 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.12 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.509 HE21 ' H ' ' A' ' 23' ' ' ASN . 29.6 mt-30 -63.17 -40.29 97.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.988 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -59.45 -57.72 11.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.762 0.315 . . . . 0.0 110.611 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -62.09 -33.82 75.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.831 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.84 95.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.869 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -60.71 -59.51 5.27 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.7 mt -56.4 -44.58 80.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 123.323 0.39 . . . . 0.0 111.293 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -62.01 -49.2 76.98 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.646 0.26 . . . . 0.0 110.759 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -63.7 -26.45 68.66 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.414 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -47.27 86.32 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.511 0.507 . . . . 0.0 109.759 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.96 -42.81 97.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.875 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.6 -36.69 85.04 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.523 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -137.73 78.64 36.25 Favored Pre-proline 0 CA--C 1.541 0.597 0 O-C-N 123.333 0.396 . . . . 0.0 110.567 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.42 -19.87 66.12 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.406 2.071 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.8 m -61.39 -29.89 70.21 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.055 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -99.2 3.91 46.55 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.2 m -44.1 -40.47 4.94 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -47.11 72.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 110.26 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -63.52 -43.81 96.08 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.894 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -57.95 -40.89 81.64 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.187 0.305 . . . . 0.0 111.015 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.25 -45.88 92.67 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.63 94.73 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.568 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -61.32 -37.96 85.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.878 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.5 94.93 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -62.74 -35.52 80.05 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.744 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.06 -46.87 88.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.569 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.6 mt -63.33 -39.3 94.17 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.496 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -62.56 -48.84 77.73 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.014 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.06 -38.39 88.62 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.095 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.4 -51.13 18.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.938 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.473 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.2 mt-30 -65.96 -27.04 67.86 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.753 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 148.52 29.73 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.126 0.266 . . . . 0.0 111.46 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.42 158.12 58.97 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.787 2.325 . . . . 0.0 112.045 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.02 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm . . . . . 0 N--CA 1.471 0.617 0 CA-C-O 120.507 0.194 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -61.68 -38.81 89.17 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.906 0.384 . . . . 0.0 110.26 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.75 -41.07 98.07 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.463 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -60.45 -38.95 85.81 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.33 0.394 . . . . 0.0 110.549 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -62.39 -51.36 67.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.658 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.11 -32.17 71.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.857 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -55.01 -61.48 2.28 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.004 0.43 . . . . 0.0 110.928 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.1 t90 -69.69 -42.01 74.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.686 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -57.93 -45.29 86.78 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.169 0.293 . . . . 0.0 111.282 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.2 -43.89 95.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.19 -28.84 67.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.2 tp -60.78 -36.37 78.8 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 123.357 0.411 . . . . 0.0 111.199 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.26 120.39 61.37 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -88.27 -20.35 1.77 Allowed 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 123.786 2.99 . . . . 0.0 116.289 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.3 p30 -91.42 -0.47 57.64 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.46 ' HA ' HE22 ' A' ' 55' ' ' GLN . 14.8 mt -71.53 137.62 48.25 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.414 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.478 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.0 t30 -57.14 148.63 21.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.031 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -52.55 -38.5 59.97 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.168 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -73.28 -39.45 65.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.33 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.478 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.1 mt-30 -66.28 -45.59 79.95 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -59.09 -43.01 91.8 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -72.37 -40.72 67.07 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.751 0.31 . . . . 0.0 110.764 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.8 97.73 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.243 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -61.8 -54.31 43.97 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.5 mt -60.77 -31.93 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -72.28 -42.76 65.18 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.055 0.455 . . . . 0.0 110.174 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.6 p -62.29 -26.08 68.21 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.438 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -53.51 -46.14 69.99 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.1 -39.75 71.91 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.152 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.79 -42.9 90.15 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.46 0.475 . . . . 0.0 111.963 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 82.59 9.23 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-O 120.872 0.368 . . . . 0.0 110.924 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -56.16 -20.15 30.03 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 122.856 2.371 . . . . 0.0 112.339 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.7 p -63.49 -27.7 69.46 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.735 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -99.58 5.11 46.04 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -43.49 -43.95 5.7 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.15 -46.24 81.68 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.879 0.371 . . . . 0.0 110.516 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.62 -43.93 92.15 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.323 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.39 -42.74 87.75 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.277 0.36 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.4 tp -60.51 -50.83 71.97 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.46 96.67 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -62.04 -36.49 81.76 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.442 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.69 98.78 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -64.12 -36.09 82.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.685 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -59.83 -44.76 93.88 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.227 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.7 -44.83 96.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.931 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -60.66 -48.56 81.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.544 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.06 -38.42 86.12 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.417 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.03 -51.49 12.22 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.46 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.0 mt-30 -65.48 -27.85 68.79 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.24 145.81 54.93 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 123.155 0.284 . . . . 0.0 111.435 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.98 164.65 26.55 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.862 2.375 . . . . 0.0 111.791 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.398 -0.811 . . . . 0.0 111.112 179.874 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.44 -38.6 87.75 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.576 0.227 . . . . 0.0 111.478 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.0 ttm -61.51 -54.49 42.56 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.273 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.06 -39.1 71.55 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.265 0.353 . . . . 0.0 111.718 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -58.64 -62.77 1.62 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 121.097 -0.241 . . . . 0.0 111.192 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.19 -27.25 67.11 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.73 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -56.53 -59.81 4.44 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.603 0.24 . . . . 0.0 111.07 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -70.58 -39.18 74.02 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.85 -41.49 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.277 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -68.61 -48.78 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.75 -29.38 66.7 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.267 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.57 -36.81 76.94 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.345 0.403 . . . . 0.0 111.332 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.13 121.71 73.39 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -87.6 -21.84 1.72 Allowed 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.57 2.847 . . . . 0.0 116.186 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -91.91 -1.09 57.47 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.456 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.1 mt -70.28 137.09 50.44 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.398 178.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.454 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.6 t-20 -58.64 145.66 39.01 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.38 -40.35 68.09 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -65.7 -45.28 83.39 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.481 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.454 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -63.62 -35.95 82.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.58 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -61.32 -61.76 2.32 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.538 0.524 . . . . 0.0 110.004 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -60.05 -38.18 82.03 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.15 87.65 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -61.58 -60.82 3.11 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.172 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -56.06 -40.06 61.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 123.351 0.407 . . . . 0.0 111.637 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -62.33 -49.84 74.01 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 m -62.36 -32.69 73.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.815 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.72 -44.79 90.53 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.076 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -63.43 -42.75 98.69 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.694 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.72 -36.96 82.46 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.211 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -147.65 86.39 6.29 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.167 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -60.95 -14.82 34.94 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 122.397 2.065 . . . . 0.0 112.253 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 t -57.81 -32.07 67.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.211 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -92.79 2.36 56.79 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.194 0.309 . . . . 0.0 111.415 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 60.7 p -44.32 -49.85 9.3 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.9 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -69.97 -48.8 56.83 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.127 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -58.28 -41.99 85.55 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.206 0.316 . . . . 0.0 110.905 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.4 -48.51 80.91 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.95 -41.18 97.68 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.674 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.14 -39.96 95.14 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.549 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.51 87.64 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -64.07 -38.21 90.25 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -62.58 -43.59 98.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.111 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.16 -47.26 85.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.485 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.4 -48.76 80.4 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.299 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.13 -38.6 83.54 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.067 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -51.28 15.54 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.967 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.456 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.18 -27.91 68.36 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.901 -179.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.37 144.77 50.72 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.259 0.349 . . . . 0.0 111.735 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.96 154.88 42.99 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 123.141 2.561 . . . . 0.0 112.356 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 118.121 -0.942 . . . . 0.0 110.543 179.719 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.1 tptm . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.6 -41.57 98.32 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.5 tpp -61.08 -48.61 80.92 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.892 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -58.21 -39.92 80.28 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.452 0.47 . . . . 0.0 111.214 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -59.58 -59.59 5.19 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.576 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.29 69.29 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.433 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -54.83 -61.2 2.46 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.867 0.365 . . . . 0.0 111.314 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.3 t90 -66.87 -41.96 86.42 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.781 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -59.67 -43.7 93.86 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.211 0.319 . . . . 0.0 111.352 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.27 -47.7 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.35 -26.36 64.98 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.309 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.24 -32.91 70.4 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 123.436 0.46 . . . . 0.0 111.74 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -57.34 138.45 80.88 Favored Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.816 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -90.13 -43.97 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 123.518 2.812 . . . . 0.0 116.516 -176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -86.8 -2.69 58.77 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -175.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.427 ' HA ' HE22 ' A' ' 55' ' ' GLN . 89.8 mt -66.9 132.25 47.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.294 -0.962 . . . . 0.0 109.143 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.556 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 6.0 m120 -57.0 158.28 5.07 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -56.32 -41.21 75.65 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.797 0.332 . . . . 0.0 111.044 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.69 -41.46 71.95 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.761 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.556 ' NE2' ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -61.22 -42.58 98.85 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.047 -179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.04 -54.41 45.2 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.105 0.478 . . . . 0.0 110.165 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -61.58 -34.69 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.9 71.63 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -60.12 -53.3 59.39 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.471 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.78 -34.06 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.837 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -64.37 -44.48 91.26 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 t -61.5 -31.53 71.53 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.174 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.39 -52.07 60.51 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.6 -39.4 93.63 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.197 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -58.38 -38.62 77.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.999 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.91 105.35 0.72 Allowed Pre-proline 0 CA--C 1.542 0.673 0 O-C-N 123.138 0.274 . . . . 0.0 111.062 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.36 -16.77 56.63 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.836 1.691 . . . . 0.0 111.067 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.2 m -57.57 -33.26 67.97 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.995 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -92.88 -3.05 55.28 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 123.192 0.308 . . . . 0.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.6 t -46.01 -38.04 7.34 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.69 73.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -67.88 -47.86 67.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.157 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -56.12 -43.73 78.44 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.335 0.397 . . . . 0.0 111.018 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.8 tp -61.52 -50.8 71.23 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.04 84.74 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.94 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -62.59 -35.64 80.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.049 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -43.89 97.76 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -62.91 -38.42 90.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.08 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -62.23 -45.09 94.87 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.112 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -44.93 95.35 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.724 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.17 -47.05 86.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.333 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.86 -36.79 82.28 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -52.0 27.6 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.278 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.429 ' NE2' HE22 ' A' ' 26' ' ' GLN . 26.9 mt-30 -72.04 -27.41 62.68 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.69 145.12 63.01 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.104 0.252 . . . . 0.0 111.474 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.6 170.0 4.87 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.694 2.263 . . . . 0.0 112.007 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp . . . . . 0 CA--C 1.548 0.882 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.673 179.801 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -58.32 -38.37 76.99 Favored 'General case' 0 C--O 1.237 0.433 0 O-C-N 123.25 0.344 . . . . 0.0 110.949 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -50.44 67.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.476 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -60.26 -37.04 79.2 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.349 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.6 -60.96 2.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.74 -31.63 72.94 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.288 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -56.01 -60.16 3.88 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.882 0.372 . . . . 0.0 111.038 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -68.76 -42.04 78.02 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.706 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -57.63 -46.85 83.62 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.281 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.5 mt -64.18 -45.98 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.65 -25.23 62.53 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.392 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.17 -37.34 74.53 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.762 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -72.65 120.24 79.6 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.208 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -89.04 -20.93 1.35 Allowed 'Trans proline' 0 N--CA 1.502 2.019 0 C-N-CA 123.666 2.91 . . . . 0.0 115.523 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.2 p30 -83.78 -2.57 56.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.468 ' HA ' HE22 ' A' ' 55' ' ' GLN . 58.2 mt -73.09 130.4 40.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.516 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.52 ' H ' HE21 ' A' ' 26' ' ' GLN . 44.7 t30 -49.89 147.11 4.04 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.815 0.697 . . . . 0.0 110.526 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -47.72 -43.15 26.69 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -68.9 -44.5 73.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.647 0.261 . . . . 0.0 110.938 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.52 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.7 mt-30 -59.88 -38.23 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.186 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -58.01 -56.05 27.07 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -71.64 -31.95 67.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.775 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.19 66.77 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -61.84 -54.25 44.71 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.0 mt -58.85 -43.05 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 123.041 0.213 . . . . 0.0 111.142 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.61 -45.81 92.5 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.908 0.385 . . . . 0.0 110.145 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 m -60.88 -31.65 71.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.553 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -47.44 83.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.425 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.11 -42.01 99.48 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.75 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.31 -35.2 78.31 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.338 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -144.59 83.64 9.61 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 123.126 0.266 . . . . 0.0 110.739 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.99 -24.6 49.43 Favored 'Trans proline' 0 N--CA 1.5 1.91 0 C-N-CA 122.652 2.235 . . . . 0.0 112.508 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -59.67 -30.67 68.93 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.751 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -96.34 5.09 51.68 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -45.41 -38.57 6.13 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.77 73.48 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.806 0.336 . . . . 0.0 110.619 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -67.14 -48.72 67.2 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.482 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.83 -42.65 80.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.172 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.77 -48.97 79.4 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.01 96.98 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.898 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -64.4 -39.76 94.49 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.863 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.19 90.75 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -63.21 -32.86 74.37 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.977 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.19 -46.54 89.39 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.189 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.2 mt -64.45 -38.0 89.49 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.157 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -60.93 -48.5 81.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.872 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.31 -37.58 88.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.147 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.42 -52.3 23.28 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.412 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.468 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.4 mt-30 -70.17 -27.64 64.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.271 -178.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.86 5.27 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 123.272 0.358 . . . . 0.0 111.718 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.42 156.96 9.99 Favored 'Trans proline' 0 N--CA 1.503 2.048 0 C-N-CA 123.15 2.566 . . . . 0.0 113.13 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.1 mmtp . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.414 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.2 mttt . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.56 -38.1 80.21 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.126 0.266 . . . . 0.0 111.704 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.6 ttm -61.0 -52.49 64.8 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.142 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -59.32 -36.41 75.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 123.273 0.358 . . . . 0.0 111.799 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -60.33 -60.94 3.02 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.116 0.26 . . . . 0.0 111.375 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.83 -28.18 66.5 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.463 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -56.39 -61.61 2.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.886 0.374 . . . . 0.0 111.085 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -67.45 -42.03 83.73 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.187 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -60.2 -46.22 90.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.118 0.261 . . . . 0.0 111.569 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.45 -48.33 85.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 121.061 -0.255 . . . . 0.0 110.372 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.8 65.59 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.424 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.3 tp -58.7 -35.93 73.43 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.447 0.467 . . . . 0.0 111.608 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.79 120.85 64.07 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -87.89 -22.08 1.56 Allowed 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 123.721 2.948 . . . . 0.0 116.403 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -89.37 -0.69 57.67 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -177.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.47 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.3 mt -72.95 138.86 46.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.692 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.51 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.9 t-20 -58.25 144.07 42.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.331 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -49.67 -42.69 46.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -68.09 -41.08 82.42 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.095 0.247 . . . . 0.0 111.309 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.51 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.9 mt-30 -63.2 -38.05 89.65 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.157 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -59.17 -60.94 3.06 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 -62.16 -33.5 74.62 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.117 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.983 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -60.17 -61.48 2.58 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.657 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.44 -43.16 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -61.25 -46.86 88.64 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.206 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.7 m -63.88 -33.7 76.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.61 -44.06 96.74 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.707 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -61.62 -40.72 95.84 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.617 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.66 -37.38 83.84 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.848 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.65 96.6 2.97 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.139 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.69 -16.34 52.34 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.089 1.859 . . . . 0.0 111.395 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.4 m -58.1 -32.63 68.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.822 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -89.12 -3.63 58.58 Favored 'General case' 0 C--O 1.225 -0.184 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.217 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 t -46.96 -39.52 12.55 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.26 -45.13 85.8 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.06 -48.07 66.61 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.285 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.9 mt -58.93 -42.69 90.36 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.234 0.334 . . . . 0.0 110.949 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.18 -48.65 80.85 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.057 0.456 . . . . 0.0 109.816 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.0 -43.4 98.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.7 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -61.08 -36.78 80.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.907 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.64 -44.43 90.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -61.9 -35.27 77.86 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.783 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -60.5 -45.47 93.66 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.097 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -65.38 -40.74 93.87 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.025 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.59 -48.68 80.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.342 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.63 -38.58 90.81 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.397 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.96 -51.44 13.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.47 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.1 mt-30 -66.43 -27.43 67.83 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.895 -178.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.43 142.97 48.79 Favored Pre-proline 0 N--CA 1.47 0.566 0 CA-C-O 120.846 0.355 . . . . 0.0 111.874 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.92 169.36 7.47 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.44 2.093 . . . . 0.0 112.013 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.645 179.207 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm . . . . . 0 C--O 1.241 0.644 0 CA-C-O 120.945 0.403 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -62.35 -35.27 78.58 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.149 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 58.2 mtt -62.21 -40.65 96.82 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -62.33 -41.83 98.89 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.72 -50.28 71.71 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.035 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.73 -34.93 77.82 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.04 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -55.48 -51.89 65.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.973 0.416 . . . . 0.0 110.802 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -66.04 -45.7 80.47 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.498 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -60.18 -40.7 90.93 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.743 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.68 -55.34 23.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.06 -31.44 65.21 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.458 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -61.71 -37.42 84.09 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.355 0.41 . . . . 0.0 111.153 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -67.58 121.21 78.18 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -87.2 -34.43 0.13 Allowed 'Trans proline' 0 N--CA 1.502 1.981 0 C-N-CA 123.346 2.698 . . . . 0.0 114.817 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.437 HD22 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -61.84 -20.31 63.53 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.134 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.472 ' HA ' HE22 ' A' ' 55' ' ' GLN . 16.5 mt -65.92 127.35 31.68 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.036 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.465 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.0 t-20 -50.18 147.13 4.37 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.072 0.857 . . . . 0.0 110.089 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -50.38 -39.83 47.84 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.53 -41.85 71.99 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.473 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.465 HE21 ' H ' ' A' ' 23' ' ' ASN . 33.4 mt-30 -61.2 -38.48 86.74 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -54.51 -63.51 1.13 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.923 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -61.52 -33.38 73.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.248 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.82 -59.35 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -61.21 -44.77 96.76 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.63 -42.0 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.098 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 46.5 mmm-85 -77.61 -33.73 53.61 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.504 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.4 p -58.13 -31.82 67.56 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.708 -0.224 . . . . 0.0 110.92 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -41.42 86.06 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.708 0.289 . . . . 0.0 110.395 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -65.35 -44.1 88.75 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.579 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.8 -38.39 81.79 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.556 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.54 88.63 3.95 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.521 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.0 -18.69 64.68 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.292 1.995 . . . . 0.0 111.982 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -60.88 -24.53 66.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.482 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.63 6.65 45.63 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.8 m -41.41 -47.44 3.61 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.84 -44.0 86.84 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -65.56 -44.89 85.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.307 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.8 mt -58.87 -42.55 89.69 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.297 0.373 . . . . 0.0 111.151 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.9 tp -60.82 -47.92 84.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.38 -43.09 99.64 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.669 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -61.75 -37.42 84.21 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.876 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.22 92.22 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -63.03 -36.22 82.85 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.652 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.18 -44.07 92.17 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.02 -43.06 99.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.956 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.437 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -61.07 -47.98 83.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 179.027 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.57 -38.83 88.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.221 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.65 -51.33 17.11 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.161 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.472 HE22 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt-30 -65.95 -27.25 68.02 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.878 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.35 145.74 35.6 Favored Pre-proline 0 N--CA 1.472 0.668 0 O-C-N 123.112 0.257 . . . . 0.0 111.597 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -74.78 153.49 42.97 Favored 'Trans proline' 0 N--CA 1.499 1.826 0 C-N-CA 122.858 2.372 . . . . 0.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.488 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.2 tptp . . . . . 0 N--CA 1.471 0.582 0 N-CA-C 111.507 0.188 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -62.73 -34.11 76.52 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.8 ttm -61.72 -47.2 86.35 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.198 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.44 -37.12 82.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.776 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -59.1 -54.81 42.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.952 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.38 68.44 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 121.205 -0.198 . . . . 0.0 111.161 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -55.44 -63.87 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.812 0.339 . . . . 0.0 111.271 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.79 -36.78 78.7 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.843 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -58.68 -42.76 89.28 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.184 -0.207 . . . . 0.0 110.92 -179.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 84.5 mt -65.95 -46.92 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -30.16 66.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.314 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.01 -36.2 76.7 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.296 0.372 . . . . 0.0 111.581 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.01 120.32 62.97 Favored Pre-proline 0 CA--C 1.543 0.673 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -88.48 -26.28 0.61 Allowed 'Trans proline' 0 N--CA 1.502 2.008 0 C-N-CA 123.717 2.945 . . . . 0.0 116.327 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 p30 -85.36 -1.78 57.37 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.2 mt -70.44 139.25 51.73 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.466 ' H ' HE21 ' A' ' 26' ' ' GLN . 21.7 t-20 -55.92 140.67 42.06 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.451 0.469 . . . . 0.0 110.853 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -45.9 -40.08 9.6 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -70.36 -45.07 66.82 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.238 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.466 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -60.59 -38.14 83.65 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.129 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -54.93 -55.84 26.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.476 0.179 . . . . 0.0 111.31 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.3 mtt85 -71.1 -33.31 70.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.216 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.75 -57.9 10.91 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -59.74 -46.0 90.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.23 -39.53 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -67.55 -42.22 83.0 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.881 0.372 . . . . 0.0 110.175 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -60.08 -35.15 74.54 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.035 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.41 -51.31 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 123.356 0.41 . . . . 0.0 110.761 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.85 -42.52 97.56 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.973 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.63 -37.76 85.18 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.674 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -142.17 79.31 16.15 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 123.159 0.287 . . . . 0.0 110.965 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -55.35 -25.09 46.06 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.79 2.327 . . . . 0.0 112.534 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -59.92 -31.27 69.67 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.464 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -91.94 4.11 53.72 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.256 0.347 . . . . 0.0 111.405 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.5 p -40.02 -55.28 2.09 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.78 -39.0 92.85 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.123 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -68.4 -49.21 61.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.48 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.27 -41.42 79.68 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.286 0.366 . . . . 0.0 111.15 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -61.86 -49.7 75.2 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.39 96.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.821 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -63.34 -38.3 90.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.585 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.69 -42.47 95.31 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -63.25 -36.13 82.65 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.584 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -59.73 -44.52 93.74 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.147 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.4 mt -62.92 -42.78 99.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.976 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -60.95 -48.23 82.77 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.338 178.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -62.05 -38.59 89.32 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.435 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.92 -51.46 12.4 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.476 HE22 ' HA ' ' A' ' 22' ' ' LEU . 17.4 mt-30 -66.32 -27.88 68.25 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.75 150.91 24.77 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.179 0.3 . . . . 0.0 111.601 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.67 153.61 69.15 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 122.927 2.418 . . . . 0.0 112.224 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.8 mptt . . . . . 0 C--O 1.221 -0.404 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.4 -179.866 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 tptm . . . . . 0 C--O 1.241 0.632 0 CA-C-O 120.747 0.308 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -61.11 -33.99 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.538 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.13 -42.94 99.61 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -62.73 -38.88 92.24 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -63.31 -52.77 60.55 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.131 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.42 74.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.037 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -55.97 -56.06 25.27 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.994 0.426 . . . . 0.0 110.988 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -69.97 -43.37 71.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.657 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -58.45 -47.93 82.38 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.277 0.361 . . . . 0.0 111.476 -178.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -63.58 -49.64 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.19 -30.47 66.47 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.523 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -60.52 -36.03 77.39 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.86 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.03 120.4 63.73 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.206 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -87.84 -18.22 2.45 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.606 2.871 . . . . 0.0 115.672 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.502 HD22 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -87.83 -5.19 58.73 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -177.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -74.03 132.08 42.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.792 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.485 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.3 t-20 -54.89 151.5 8.58 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.985 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -54.47 -39.93 67.95 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.78 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -71.65 -45.55 61.65 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.068 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.485 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.5 mt-30 -61.26 -45.15 95.69 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.071 -178.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.05 -52.18 66.46 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.174 0.296 . . . . 0.0 111.11 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -66.21 -33.84 76.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.271 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.77 96.73 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.18 -0.463 . . . . 0.0 112.172 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -61.29 -62.07 2.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.8 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.5 mt -56.21 -41.85 71.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 123.119 0.262 . . . . 0.0 111.527 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -62.79 -51.01 68.78 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 120.964 0.411 . . . . 0.0 110.306 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 89.5 p -64.05 -23.9 67.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.245 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -46.51 89.68 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -64.3 -44.47 91.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.371 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -61.41 -38.27 86.48 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.303 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -135.59 81.54 41.6 Favored Pre-proline 0 CA--C 1.549 0.909 0 O-C-N 123.398 0.436 . . . . 0.0 110.347 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -63.18 -17.46 60.25 Favored 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 121.909 1.739 . . . . 0.0 112.461 -179.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.7 p -65.2 -26.59 68.2 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.23 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -101.96 4.44 39.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.7 m -45.05 -38.91 5.26 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.31 -45.98 74.9 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.702 0.286 . . . . 0.0 110.346 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.68 -46.06 80.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.7 -41.24 81.3 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.336 0.397 . . . . 0.0 111.014 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.9 tp -61.08 -49.02 79.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.9 99.56 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.821 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -61.37 -39.31 90.17 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.841 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.46 97.42 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -65.3 -35.67 81.72 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.711 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -59.39 -47.35 85.77 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.54 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -63.66 -38.16 90.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.19 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.502 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.77 -48.67 78.14 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.869 178.817 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.21 -38.54 89.55 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.14 -51.25 18.63 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.092 -178.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.466 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.7 mt-30 -66.29 -26.18 67.2 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.912 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.31 145.9 34.49 Favored Pre-proline 0 N--CA 1.471 0.611 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.16 153.5 46.29 Favored 'Trans proline' 0 N--CA 1.498 1.78 0 C-N-CA 122.926 2.417 . . . . 0.0 112.376 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 89.7 mttt . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.524 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 tptm . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 120.514 0.197 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.99 -40.13 92.32 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.4 mtt -64.4 -38.68 91.87 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.163 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -59.76 -40.0 86.69 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.308 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -64.33 -54.99 24.39 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.53 -34.0 76.82 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.933 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -57.88 -57.55 12.3 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.856 0.36 . . . . 0.0 111.439 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -68.99 -44.95 71.82 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.436 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -59.44 -46.4 88.84 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.606 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.55 -42.85 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.296 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.22 -32.57 70.08 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.084 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.54 -33.76 76.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.719 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -61.99 119.12 45.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 122.958 0.161 . . . . 0.0 111.115 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -89.59 -42.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 123.583 2.855 . . . . 0.0 114.796 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.86 -36.82 75.22 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.442 ' HA ' HE22 ' A' ' 55' ' ' GLN . 8.6 mp -63.62 130.43 44.25 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.326 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.404 ' H ' HE21 ' A' ' 26' ' ' GLN . 62.7 t30 -51.12 146.94 5.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.407 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -53.78 -38.07 64.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.652 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.64 -43.04 99.81 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.364 0.415 . . . . 0.0 110.457 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.404 HE21 ' H ' ' A' ' 23' ' ' ASN . 34.6 mt-30 -65.65 -43.48 89.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.361 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -62.68 -50.93 69.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.578 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -62.06 -40.97 97.59 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.681 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.61 -34.46 77.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.791 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -63.41 -59.07 5.16 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.175 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.417 HG22 HD12 ' A' ' 31' ' ' ILE . 63.6 mt -61.74 -32.99 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.704 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.09 -46.36 71.2 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.216 0.532 . . . . 0.0 109.683 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 96.5 p -64.99 -21.93 66.92 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.993 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -48.64 80.86 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -66.35 -41.8 89.02 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.716 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.76 -36.82 84.29 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.385 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -147.66 78.6 9.86 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.228 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.61 -27.73 85.35 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.544 2.163 . . . . 0.0 112.437 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 m -58.99 -30.34 67.9 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.703 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.8 5.76 44.68 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.5 t -45.51 -38.09 5.97 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.3 0.5 . . . . 0.0 111.777 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.06 -46.52 70.84 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.319 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -66.88 -45.84 76.83 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.11 -41.66 79.39 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.546 0.529 . . . . 0.0 110.99 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.72 -49.21 75.97 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.59 81.97 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.839 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -62.5 -32.88 73.87 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.488 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.13 -41.75 90.04 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -61.44 -35.21 76.96 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.891 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.42 -51.31 66.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.03 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.51 -39.46 94.49 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.045 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -56.64 -47.93 78.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.08 -31.88 72.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.389 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -53.12 34.69 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.442 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.8 mt-30 -80.89 -26.24 36.97 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.73 157.17 8.06 Favored Pre-proline 0 N--CA 1.472 0.667 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.94 159.05 4.13 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 123.0 2.467 . . . . 0.0 112.464 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt . . . . . 0 CA--C 1.546 0.819 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.604 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 C--O 1.24 0.599 0 CA-C-O 120.966 0.413 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.87 -35.03 77.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.319 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.9 mtt -62.04 -41.55 98.24 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.246 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -62.33 -42.94 99.79 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.348 0.405 . . . . 0.0 109.926 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -61.92 -50.3 72.71 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.35 -31.77 71.4 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.017 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -56.19 -56.62 18.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.819 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.73 -41.28 79.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.069 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -58.67 -42.88 89.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 121.176 -0.209 . . . . 0.0 111.451 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.32 -52.2 55.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.98 68.1 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.402 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.2 tp -60.59 -36.48 78.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.598 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.12 119.67 71.6 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -88.18 -24.22 1.02 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 123.651 2.901 . . . . 0.0 115.69 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.519 HD22 ' ND2' ' A' ' 52' ' ' ASN . 2.0 p30 -80.6 -6.3 58.09 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.479 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.6 mt -71.7 132.2 44.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.941 -0.703 . . . . 0.0 109.202 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.471 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.2 t30 -51.73 151.96 3.11 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.712 0.633 . . . . 0.0 110.926 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -50.95 -40.79 58.26 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -74.93 -48.04 26.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.849 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.471 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.2 mt-30 -59.73 -45.7 91.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.226 -178.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 ttmm -56.59 -47.36 79.74 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.287 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -79.54 -32.13 42.14 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.873 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -45.56 91.54 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -59.24 -58.63 7.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.544 -0.462 . . . . 0.0 112.054 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -54.94 -46.05 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 O-C-N 123.094 0.246 . . . . 0.0 111.557 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -62.88 -47.24 84.16 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.767 0.318 . . . . 0.0 110.547 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -61.22 -30.61 70.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.002 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -44.89 92.58 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.07 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.24 -39.53 94.14 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.575 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -67.14 -38.45 85.57 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.706 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -140.06 74.82 30.35 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.225 0.328 . . . . 0.0 110.454 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.87 -16.41 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 112.428 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.2 m -61.48 -29.71 70.14 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.15 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.435 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 51.2 mm-40 -105.06 9.71 34.27 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.8 m -44.29 -35.08 2.16 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.21 69.39 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.204 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.435 ' ND2' ' HB3' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -71.0 -37.03 72.66 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.24 -178.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.08 -44.46 96.63 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.64 -48.43 81.81 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.74 91.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.846 178.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -63.72 -37.24 86.61 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.806 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.31 93.81 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -63.5 -35.65 81.17 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.943 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -59.13 -47.99 83.26 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.571 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.32 -38.84 92.72 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.174 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.519 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.52 -48.26 80.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.885 178.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.46 -38.48 89.99 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.086 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.28 -51.26 15.8 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.479 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.2 mt-30 -65.37 -26.84 68.19 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.37 157.31 4.97 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.15 0.281 . . . . 0.0 111.672 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.2 156.51 5.27 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 123.101 2.534 . . . . 0.0 112.954 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.883 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt . . . . . 0 C--O 1.24 0.574 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -61.1 -39.26 89.27 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.498 ' SD ' ' CD2' ' A' ' 34' ' ' LEU . 1.6 mmm -62.8 -43.27 99.23 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.932 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -60.18 -40.11 88.84 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.293 0.37 . . . . 0.0 110.571 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -59.64 -55.85 29.26 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.305 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.68 -29.99 66.44 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -57.24 -59.67 4.76 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.867 0.365 . . . . 0.0 111.179 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -67.85 -42.55 81.22 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.121 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.25 -46.44 89.79 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.129 0.268 . . . . 0.0 111.52 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.48 -47.44 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.274 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.4 -29.38 66.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.533 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -59.88 -36.73 77.54 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 123.264 0.352 . . . . 0.0 111.471 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 120.98 69.4 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -86.88 -34.44 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.258 2.639 . . . . 0.0 114.652 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.461 HD22 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -64.42 -19.29 65.43 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.461 ' HA ' HE22 ' A' ' 55' ' ' GLN . 13.1 mt -64.0 132.1 49.6 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.938 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.458 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.7 t-20 -55.58 143.18 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -50.23 -39.14 43.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -67.03 -43.95 81.48 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.86 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.458 HE21 ' H ' ' A' ' 23' ' ' ASN . 32.7 mt-30 -62.5 -36.96 84.17 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.883 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -59.31 -62.94 1.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 110.694 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.29 -34.94 74.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.15 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.15 -48.45 81.56 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.412 0.445 . . . . 0.0 111.986 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.56 -61.43 2.59 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.253 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.413 HG22 HD13 ' A' ' 31' ' ' ILE . 51.4 mt -54.51 -39.42 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 O-C-N 123.336 0.397 . . . . 0.0 111.963 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.84 -50.49 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.7 m -63.53 -34.93 78.87 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.829 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.498 ' CD2' ' SD ' ' A' ' 9' ' ' MET . 3.9 tt -59.11 -42.22 90.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.955 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -63.11 -45.42 92.09 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.53 -36.76 85.25 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.452 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -139.14 82.0 20.21 Favored Pre-proline 0 CA--C 1.545 0.761 0 O-C-N 123.334 0.396 . . . . 0.0 111.521 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.7 -17.38 49.26 Favored 'Trans proline' 0 N--CA 1.505 2.149 0 C-N-CA 122.499 2.132 . . . . 0.0 111.993 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.7 m -57.26 -33.78 67.96 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.288 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -91.62 -0.59 57.59 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 123.187 0.304 . . . . 0.0 111.521 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.6 t -46.11 -37.78 7.28 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 117.694 0.224 . . . . 0.0 111.579 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -45.51 70.5 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -66.82 -47.27 72.53 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.051 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.52 -40.45 82.93 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.305 0.378 . . . . 0.0 110.752 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 15.4 tp -61.02 -49.04 79.01 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.703 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -61.44 -38.16 86.15 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.655 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.1 96.43 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 tttt -64.52 -37.57 88.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.161 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -60.65 -44.3 96.59 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.794 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.1 mt -62.45 -44.57 96.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.508 178.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.461 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -59.5 -48.14 82.79 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.401 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.25 -37.95 84.95 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.036 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.01 17.42 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.954 -178.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.461 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.1 mt-30 -65.34 -27.25 68.46 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.894 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -52.92 151.76 8.11 Favored Pre-proline 0 N--CA 1.475 0.777 0 O-C-N 123.213 0.321 . . . . 0.0 111.835 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.4 170.41 4.22 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.742 2.294 . . . . 0.0 112.152 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.7 mttt . . . . . 0 N--CA 1.477 0.913 0 O-C-N 124.285 0.991 . . . . 0.0 110.778 179.96 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 mptt . . . . . 0 C--O 1.238 0.488 0 CA-C-O 120.73 0.3 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -61.25 -34.13 74.65 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.67 -42.92 99.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.432 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.44 -38.74 92.3 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -63.59 -53.89 44.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.766 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -31.83 72.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.057 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -56.72 -56.11 25.56 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.02 0.438 . . . . 0.0 110.594 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -68.38 -44.58 74.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.588 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.35 -42.05 94.9 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.0 mt -65.01 -49.78 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.37 -25.13 61.69 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.17 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.02 -37.68 74.77 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.356 0.41 . . . . 0.0 111.98 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -69.93 119.9 74.44 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -89.01 -20.73 1.39 Allowed 'Trans proline' 0 N--CA 1.5 1.899 0 C-N-CA 123.208 2.605 . . . . 0.0 115.134 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 p30 -86.97 -2.57 58.72 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.446 ' HA ' HE22 ' A' ' 55' ' ' GLN . 39.8 mt -71.36 135.13 47.16 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.387 178.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.466 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -51.33 143.64 11.13 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.586 0.554 . . . . 0.0 110.095 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -47.97 -39.96 20.99 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.403 0.439 . . . . 0.0 112.152 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.65 -44.4 74.19 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.023 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.466 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.5 mt-30 -62.68 -36.95 84.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.111 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -57.55 -56.78 17.43 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.666 0.269 . . . . 0.0 110.973 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -68.71 -34.53 75.8 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.182 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.61 -52.41 63.89 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -59.45 -61.25 2.76 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 120.422 -0.511 . . . . 0.0 112.118 -178.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.7 -41.67 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.188 0.305 . . . . 0.0 111.657 -178.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.0 ttt-85 -63.28 -49.28 74.68 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.924 0.392 . . . . 0.0 110.175 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 57.1 m -61.19 -30.22 70.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.024 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.14 -43.86 92.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.061 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -66.17 -41.95 89.6 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.011 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -43.11 88.41 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.876 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -135.94 74.51 57.03 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.018 0.437 . . . . 0.0 110.638 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -60.68 -11.03 15.75 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.486 2.124 . . . . 0.0 113.11 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.4 p -62.02 -25.08 67.45 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.83 16.81 19.4 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -48.56 -37.24 17.32 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.86 -45.23 90.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.425 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -64.3 -47.17 80.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.113 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.81 -41.86 78.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.408 0.443 . . . . 0.0 111.267 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.56 -49.99 75.34 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.03 99.74 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.764 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -59.92 -38.08 81.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.864 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -47.76 81.01 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -62.53 -37.78 87.43 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.336 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -60.2 -45.29 93.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.272 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 mt -64.87 -39.8 94.13 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -60.02 -49.1 79.0 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.429 0.456 . . . . 0.0 110.307 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.63 -38.87 89.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.265 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.51 -51.37 14.93 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.446 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.1 mt-30 -65.45 -27.94 68.87 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.614 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.34 145.0 59.96 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.288 0.367 . . . . 0.0 111.467 -179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.47 151.62 47.92 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.923 2.415 . . . . 0.0 112.261 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt . . . . . 0 C--O 1.223 -0.329 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.408 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.569 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -40.84 97.36 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.507 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -58.49 -41.29 84.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.457 0.473 . . . . 0.0 110.806 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -63.22 -54.97 29.07 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.146 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.55 78.24 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.291 -179.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -55.89 -53.01 61.94 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.904 0.383 . . . . 0.0 111.153 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.4 t90 -67.54 -46.38 72.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.219 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.41 -43.5 96.65 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.846 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 93.2 mt -64.74 -48.96 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -31.34 68.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.304 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.51 -35.96 77.2 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.295 0.372 . . . . 0.0 111.531 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -67.67 120.24 71.95 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -88.62 -26.92 0.49 Allowed 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 123.663 2.908 . . . . 0.0 116.297 -178.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -83.71 -0.66 51.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -176.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.477 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.0 mt -72.28 135.21 45.92 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.319 178.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.462 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.4 t-20 -54.11 142.84 24.15 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.654 0.596 . . . . 0.0 110.234 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -47.6 -42.63 24.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -66.61 -41.47 88.34 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.287 0.367 . . . . 0.0 111.383 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.462 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.98 -41.36 95.51 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.063 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -52.99 -54.38 35.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.717 0.294 . . . . 0.0 111.172 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -71.43 -36.05 71.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.401 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.83 -55.37 36.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -60.25 -54.13 49.4 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.9 mt -58.22 -41.1 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.188 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -64.81 -48.03 75.88 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.04 0.447 . . . . 0.0 109.999 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.2 t -61.81 -24.99 67.22 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.361 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.14 -43.94 98.11 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.649 0.593 . . . . 0.0 109.52 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -67.18 -39.9 86.5 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -64.6 -30.63 71.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.339 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -144.74 76.62 13.96 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 120.771 0.319 . . . . 0.0 110.683 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -54.42 -31.41 68.27 Favored 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.987 2.458 . . . . 0.0 112.698 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -59.36 -28.45 66.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.203 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -92.74 1.88 57.04 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.2 t -44.02 -41.66 5.57 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.69 -46.0 76.99 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.667 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -67.18 -46.11 74.95 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.181 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -57.73 -43.45 85.34 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.159 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.7 tp -60.92 -49.87 75.72 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.38 97.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.804 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -62.57 -39.02 92.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.348 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -40.95 97.13 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -63.81 -36.38 83.71 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.586 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -59.81 -44.31 94.05 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.15 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.54 -43.09 99.67 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.1 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.24 -48.38 81.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.29 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -61.76 -38.42 87.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.494 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.47 -51.55 11.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.477 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.5 mt-30 -65.8 -27.92 68.63 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 146.04 56.64 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.166 0.291 . . . . 0.0 111.485 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.82 153.76 58.77 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.997 2.465 . . . . 0.0 112.22 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mttp . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.484 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.2 mttt . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.98 -43.19 99.47 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.362 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.17 -44.72 94.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.967 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -57.68 -41.43 81.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.318 0.387 . . . . 0.0 111.05 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -61.01 -57.14 13.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.465 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -30.33 68.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.456 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.37 -58.99 5.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.895 0.379 . . . . 0.0 110.97 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -65.74 -43.26 89.49 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.652 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -59.91 -50.75 72.56 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.186 0.303 . . . . 0.0 111.27 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 89.7 mt -63.57 -47.08 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 120.575 0.226 . . . . 0.0 110.484 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.41 -29.42 64.11 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.64 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -60.65 -36.98 80.04 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.241 0.338 . . . . 0.0 111.641 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.32 120.02 61.31 Favored Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -88.85 -26.18 0.55 Allowed 'Trans proline' 0 N--CA 1.503 2.038 0 C-N-CA 123.696 2.931 . . . . 0.0 116.28 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -84.62 -0.44 53.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.475 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.6 mt -72.84 135.65 45.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.579 178.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.482 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.9 t-20 -53.89 143.52 21.15 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.698 0.624 . . . . 0.0 110.136 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -47.85 -40.74 22.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -68.8 -43.13 76.26 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.684 0.278 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.482 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.6 mt-30 -63.81 -37.73 88.48 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.273 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -56.36 -55.07 38.03 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.733 0.302 . . . . 0.0 111.279 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm180 -72.21 -31.9 66.27 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.494 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.1 -50.34 73.1 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.4 -55.41 31.8 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.417 HD11 HG21 ' A' ' 31' ' ' ILE . 49.2 mt -56.79 -38.34 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 122.966 0.166 . . . . 0.0 111.31 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 mmm-85 -65.94 -42.29 90.24 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.5 t -61.89 -30.58 70.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.084 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.51 -51.07 63.99 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.781 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.27 -39.51 94.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -56.98 -38.08 72.52 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.599 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.92 104.62 1.15 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 121.165 -0.214 . . . . 0.0 111.19 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.18 -17.39 59.54 Favored 'Trans proline' 0 N--CA 1.502 1.971 0 C-N-CA 121.898 1.732 . . . . 0.0 111.69 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.3 p -59.52 -30.71 68.77 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -96.39 1.14 51.49 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.124 0.265 . . . . 0.0 111.461 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.3 p -43.7 -51.82 6.88 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.54 91.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.744 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -69.11 -49.06 60.5 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.295 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.2 mt -56.72 -45.09 82.09 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.495 0.497 . . . . 0.0 110.923 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.99 -52.21 66.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.27 86.68 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.056 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -62.54 -37.72 87.22 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.261 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.64 95.65 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -63.54 -35.47 80.58 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.783 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -59.64 -47.14 86.77 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.342 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.9 mt -63.36 -39.74 95.36 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.335 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -61.3 -48.43 81.43 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.316 0.385 . . . . 0.0 110.114 178.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -62.4 -38.68 90.6 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.312 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.34 -51.56 12.88 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.475 HE22 ' HA ' ' A' ' 22' ' ' LEU . 18.7 mt-30 -66.35 -27.93 68.27 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.23 146.44 61.97 Favored Pre-proline 0 CA--C 1.537 0.466 0 O-C-N 123.206 0.316 . . . . 0.0 111.327 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.18 158.8 55.16 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.846 2.364 . . . . 0.0 111.989 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt . . . . . 0 CA--C 1.541 0.609 0 O-C-N 124.059 0.85 . . . . 0.0 110.923 -179.975 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 120.498 0.19 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.28 -44.22 97.59 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.361 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -38.73 92.22 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -59.21 -39.22 81.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.63 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -65.26 -55.24 19.54 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.057 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.8 -34.96 79.07 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.949 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -56.57 -52.95 62.88 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.214 0.531 . . . . 0.0 110.625 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -62.53 -46.01 90.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.775 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -61.09 -42.31 98.27 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -178.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.3 mt -62.34 -53.86 41.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 120.638 0.256 . . . . 0.0 110.421 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.83 -30.58 67.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.37 -37.14 79.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 123.242 0.339 . . . . 0.0 111.203 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.65 120.8 68.92 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.14 -21.6 1.57 Allowed 'Trans proline' 0 N--CA 1.504 2.134 0 C-N-CA 123.824 3.016 . . . . 0.0 116.236 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -89.85 -0.15 57.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -176.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.8 mt -74.89 138.37 42.39 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.85 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.501 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.3 t-20 -60.94 145.93 48.65 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.834 178.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -51.38 -42.38 61.35 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.06 -37.95 81.86 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.221 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.501 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.3 mt-30 -67.32 -53.96 24.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -56.34 -48.58 76.49 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.68 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.9 mtt85 -63.25 -33.44 75.51 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.763 178.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.66 -55.64 16.42 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -60.0 -41.2 91.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.146 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 mm -57.05 -42.3 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -72.55 -35.69 68.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.194 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -57.51 -33.66 68.29 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.508 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.72 -53.6 37.58 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.168 0.292 . . . . 0.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.16 -39.69 95.39 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.051 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.26 -40.86 95.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.503 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -151.31 82.92 5.63 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 123.243 0.339 . . . . 0.0 110.332 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.76 -24.97 80.18 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.411 2.074 . . . . 0.0 112.13 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -59.6 -33.15 71.1 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.172 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -88.76 8.69 27.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.439 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.3 p -43.35 -48.74 6.97 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.94 95.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.696 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.35 -47.26 61.84 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.294 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -58.14 -43.97 87.6 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.314 0.384 . . . . 0.0 110.857 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.78 -49.08 78.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.14 -41.92 97.6 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.881 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -62.89 -37.69 87.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.824 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.27 90.75 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -63.17 -36.31 83.21 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.624 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -58.54 -43.7 89.36 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.352 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.11 -41.98 99.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.988 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -62.68 -47.81 82.05 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.326 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -61.76 -37.86 85.85 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.348 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.78 -50.69 14.49 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.476 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.0 mt-30 -67.88 -27.46 66.68 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 -178.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 158.48 5.58 Favored Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.19 155.8 11.36 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.151 2.567 . . . . 0.0 112.993 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.3 mptt . . . . . 0 CA--C 1.534 0.357 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.414 -179.871 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -61.97 -41.82 98.44 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.742 -179.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.415 ' SD ' ' HB3' ' A' ' 38' ' ' PRO . 73.7 mtm -64.26 -37.05 86.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.878 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -61.04 -39.8 91.19 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -61.75 -43.47 98.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.953 179.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.05 -40.13 87.05 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.259 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -48.93 76.94 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.566 179.908 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -61.37 -44.41 97.21 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -61.36 -39.93 92.45 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 82.0 mt -60.97 -52.77 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.279 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.31 -31.42 67.49 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.424 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.99 -35.76 77.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.573 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.466 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -70.26 121.71 84.05 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.495 -179.282 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -87.34 -22.81 1.59 Allowed 'Trans proline' 0 N--CA 1.507 2.268 0 C-N-CA 123.823 3.015 . . . . 0.0 115.259 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.95 79.98 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -177.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' CD1' ' HB3' ' A' ' 19' ' ' LEU . 4.1 mp -73.01 132.31 43.23 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.977 0.417 . . . . 0.0 111.025 -178.714 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.454 ' H ' HE21 ' A' ' 26' ' ' GLN . 0.2 OUTLIER -55.36 156.98 3.97 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.101 179.857 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -57.07 -42.13 80.04 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.305 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -43.92 96.1 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.859 -179.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.454 HE21 ' H ' ' A' ' 23' ' ' ASN . 35.4 mt-30 -62.99 -39.06 93.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.71 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -58.4 -64.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.935 -179.384 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -59.58 -34.22 72.44 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.721 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.24 -43.77 95.79 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.281 0.363 . . . . 0.0 111.53 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -63.54 -52.52 60.77 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.93 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.0 mm -56.41 -46.03 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -61.49 -47.79 84.03 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 120.679 0.276 . . . . 0.0 110.358 179.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.8 t -62.34 -30.46 71.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.246 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.18 -51.47 69.6 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.449 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -62.28 -40.52 96.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.678 179.086 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.77 -40.05 93.81 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.116 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -136.76 82.89 31.01 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.668 -179.357 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HB3' ' SD ' ' A' ' 9' ' ' MET . 51.7 Cg_exo -53.49 -28.23 44.01 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.869 2.379 . . . . 0.0 112.424 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.5 -35.01 73.32 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.008 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -82.66 -1.47 51.21 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.0 p -41.31 -54.43 3.0 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.74 92.35 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -67.95 -50.22 57.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.745 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -57.05 -40.76 77.43 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 123.091 0.244 . . . . 0.0 111.15 -178.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.4 tp -61.49 -50.3 73.29 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.732 179.164 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.18 89.83 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.824 178.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -62.19 -36.5 82.1 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.58 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.58 -39.66 91.85 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -63.68 -39.65 94.84 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.609 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.83 -51.89 66.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.37 -36.3 83.57 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -49.11 78.79 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.371 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -63.68 -37.03 85.79 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.729 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.7 -52.25 13.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -177.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.435 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.5 mt-30 -68.31 -25.88 65.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 -179.052 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.52 149.45 39.79 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 123.06 0.225 . . . . 0.0 111.085 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.93 155.01 62.85 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 122.776 2.318 . . . . 0.0 112.272 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? . . . . . 0 N--CA 1.476 0.83 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.865 179.921 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -57.96 -46.49 85.01 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 120.803 0.335 . . . . 0.0 111.115 -178.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -50.3 72.32 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.48 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -55.78 -41.55 74.22 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 123.569 0.543 . . . . 0.0 111.61 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -58.42 -61.89 2.25 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.501 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.29 -23.52 64.76 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.294 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -58.71 -58.93 6.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . 0.449 ' CD1' ' C ' ' A' ' 14' ' ' TRP . 0.4 OUTLIER -73.58 -35.45 65.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.515 -178.937 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.68 -47.46 85.55 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.198 0.311 . . . . 0.0 110.793 -179.286 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.58 -49.92 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.832 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.0 -24.94 42.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.773 -178.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.1 tp -56.7 -39.03 73.12 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.359 0.412 . . . . 0.0 111.899 -179.044 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -68.73 120.89 78.83 Favored Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -179.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -89.19 -9.94 4.18 Favored 'Trans proline' 0 N--CA 1.504 2.119 0 C-N-CA 123.597 2.865 . . . . 0.0 115.671 -178.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.4 p30 -95.84 -1.43 49.53 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.44 ' HA ' HE22 ' A' ' 55' ' ' GLN . 29.2 mt -75.25 130.36 38.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.69 178.759 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.433 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.8 t-20 -53.89 148.12 10.96 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.628 0.58 . . . . 0.0 109.612 179.158 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -53.05 -44.0 67.07 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -65.54 -42.17 92.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.177 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.433 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.0 mt-30 -65.22 -48.2 74.18 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.303 -179.428 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -61.34 -49.13 78.2 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 123.303 0.377 . . . . 0.0 110.688 -179.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.74 -39.51 91.84 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.641 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.03 -44.44 95.92 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.156 -179.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -60.31 -56.93 15.53 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.649 -179.145 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.1 mt -57.89 -44.19 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 123.162 0.289 . . . . 0.0 110.978 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.7 ttt-85 -62.17 -50.02 73.5 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.843 0.354 . . . . 0.0 110.616 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 t -58.15 -29.31 65.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -45.61 91.46 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -64.12 -39.74 94.68 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.368 178.686 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -59.81 -36.29 76.47 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.05 92.68 2.58 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.82 -179.843 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.98 -18.68 51.63 Favored 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.381 2.054 . . . . 0.0 111.901 179.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.1 p -59.43 -25.32 64.24 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.811 -179.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -102.26 0.87 35.07 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.3 m -46.1 -39.74 9.86 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.78 84.1 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -67.3 -48.05 68.78 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.28 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.1 mt -57.46 -43.01 83.65 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.233 0.333 . . . . 0.0 111.056 -179.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.0 -50.96 71.69 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.26 0.553 . . . . 0.0 109.687 179.083 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.0 -41.33 96.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.04 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -63.72 -38.12 89.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.776 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.62 -44.69 93.19 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -63.49 -32.96 74.55 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.05 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -60.27 -47.47 85.85 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.953 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.8 mt -63.82 -37.11 86.15 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.004 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -62.66 -48.77 77.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.988 178.928 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.52 -38.75 91.18 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.88 -51.58 15.74 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.161 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.44 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.5 -27.5 67.83 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.067 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.48 145.44 48.74 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 123.237 0.335 . . . . 0.0 111.588 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.28 154.71 41.41 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 123.084 2.523 . . . . 0.0 112.476 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.392 179.805 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -62.95 -40.03 96.42 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.669 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -39.36 93.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.555 179.308 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -59.28 -43.59 92.51 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 123.378 0.424 . . . . 0.0 110.649 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -62.75 -50.83 69.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.268 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.05 78.34 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.139 -179.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -55.8 -55.82 27.87 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.969 0.414 . . . . 0.0 110.895 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -64.98 -45.66 84.73 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.442 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -58.61 -49.48 77.32 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.511 -178.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 85.6 mt -57.76 -50.17 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.662 0.268 . . . . 0.0 110.877 179.621 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.57 -25.42 64.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.935 -179.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.81 -38.28 84.86 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.238 0.336 . . . . 0.0 110.889 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.58 121.11 75.72 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.016 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.75 -8.05 5.25 Favored 'Trans proline' 0 N--CA 1.503 2.031 0 C-N-CA 123.592 2.862 . . . . 0.0 115.587 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -98.97 -2.3 37.73 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.929 0.714 . . . . 0.0 112.929 -177.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' HA ' HE22 ' A' ' 55' ' ' GLN . 30.3 mt -75.98 130.9 39.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.451 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.533 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -52.28 145.61 10.65 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.199 179.407 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -50.79 -41.0 56.74 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.806 -178.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.59 -42.11 83.03 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.926 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.533 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.8 mt-30 -62.31 -42.18 99.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.697 -179.053 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm -55.42 -63.8 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.632 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -58.21 -32.24 68.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.247 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.77 -62.31 1.89 Allowed 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.174 0.297 . . . . 0.0 111.209 -179.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -61.55 -40.29 94.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.086 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.4 -39.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.291 179.025 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -75.1 -39.31 60.79 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.571 178.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.3 m -55.0 -35.45 64.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.544 -179.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.33 -43.98 71.7 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.248 0.342 . . . . 0.0 110.527 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -68.43 -41.01 80.97 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.173 178.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.22 -41.89 94.03 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.098 -178.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.17 85.21 6.98 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 120.862 0.363 . . . . 0.0 111.098 -179.349 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -54.83 -23.73 35.23 Favored 'Trans proline' 0 N--CA 1.502 1.988 0 C-N-CA 122.908 2.405 . . . . 0.0 112.755 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.7 p -61.91 -27.76 69.04 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.809 -179.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -96.13 8.01 44.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -178.666 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m -44.78 -40.87 6.45 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -178.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -45.39 75.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.788 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -67.52 -48.29 67.47 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.705 -179.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -57.33 -45.53 84.17 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.225 0.328 . . . . 0.0 111.291 -178.75 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.2 tp -60.1 -49.34 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.34 -40.5 94.49 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.817 178.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -64.17 -38.98 92.99 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 179.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.55 -46.55 82.32 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.558 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -63.27 -32.2 73.54 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.046 179.306 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.2 -44.44 95.11 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.897 179.112 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.7 mt -63.21 -39.42 94.57 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.906 178.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -62.98 -49.14 75.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.247 178.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.42 -38.61 90.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.256 -179.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.52 -51.62 14.19 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.455 HE22 ' HA ' ' A' ' 22' ' ' LEU . 26.3 mt-30 -66.2 -27.34 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.132 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 145.33 60.13 Favored Pre-proline 0 CA--C 1.539 0.524 0 O-C-N 123.227 0.329 . . . . 0.0 111.266 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -74.74 153.45 43.14 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 122.895 2.396 . . . . 0.0 112.42 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.44 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.6 t . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.54 -67.86 0.42 Allowed 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.43 -61.48 1.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.383 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -176.93 152.4 0.93 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.178 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -79.35 56.21 2.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.437 0.637 . . . . 0.0 111.753 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -66.11 -29.02 69.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.487 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -56.5 -38.38 71.69 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.305 -0.407 . . . . 0.0 112.091 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -61.68 -40.01 93.44 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.406 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 12.6 mtt -66.0 -39.56 90.38 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.753 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -58.01 -45.1 87.44 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.502 0.501 . . . . 0.0 110.742 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.43 -51.31 68.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.91 68.26 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.109 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.98 -64.89 0.78 Allowed 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.796 0.331 . . . . 0.0 110.769 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -71.06 -36.23 72.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.91 -40.73 81.09 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.995 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.67 -44.73 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.89 64.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.157 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.15 -37.63 80.69 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.938 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -66.02 120.87 72.86 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 120.32 -0.552 . . . . 0.0 109.877 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.37 -7.89 5.66 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.665 2.91 . . . . 0.0 115.78 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -99.18 -2.17 37.46 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.454 ' HA ' HE22 ' A' ' 55' ' ' GLN . 32.4 mt -74.51 133.26 42.32 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.314 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.463 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -53.09 146.8 10.68 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.067 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -51.96 -40.7 61.28 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -68.24 -42.51 79.61 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.95 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.463 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.17 -43.37 95.35 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.716 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -57.15 -48.0 79.77 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.54 0.21 . . . . 0.0 111.16 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.31 -35.85 68.74 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.62 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.14 -56.77 17.91 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -59.95 -45.81 91.43 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.796 -0.361 . . . . 0.0 111.947 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.444 HD11 HG22 ' A' ' 31' ' ' ILE . 44.8 mt -58.6 -38.66 72.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.664 179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -74.24 -32.53 63.01 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -58.23 -33.22 69.11 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.842 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -52.64 -50.27 63.5 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -63.27 -39.19 93.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.112 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.28 -38.28 79.77 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.701 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.46 84.53 2.55 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 120.859 0.361 . . . . 0.0 110.728 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.07 -25.22 44.1 Favored 'Trans proline' 0 N--CA 1.502 1.976 0 C-N-CA 122.834 2.356 . . . . 0.0 112.631 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.6 p -60.41 -30.91 69.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.556 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -92.08 8.83 36.0 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.171 0.295 . . . . 0.0 111.767 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.0 p -43.65 -50.86 7.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.45 92.95 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.322 0.389 . . . . 0.0 110.895 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -70.37 -49.62 47.31 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -57.0 -44.82 83.17 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.319 0.387 . . . . 0.0 111.054 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.9 tp -60.2 -48.64 80.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.96 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.81 -43.37 98.99 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -61.22 -38.89 88.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.939 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.92 88.4 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -63.1 -32.42 73.79 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.943 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -60.77 -43.66 97.75 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.84 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.82 -39.67 95.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.802 178.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -63.42 -49.83 72.21 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.093 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.56 -38.57 90.57 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.21 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -51.55 15.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.454 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.9 mt-30 -65.83 -27.27 68.12 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.28 145.33 57.74 Favored Pre-proline 0 CA--C 1.54 0.558 0 O-C-N 123.144 0.278 . . . . 0.0 111.277 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.39 170.03 5.83 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.515 2.144 . . . . 0.0 111.805 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 CA--C 1.547 0.864 0 CA-C-O 117.565 -1.207 . . . . 0.0 110.606 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.37 -65.89 0.76 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.929 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -90.38 -61.22 1.73 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.207 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 mmtp -178.05 155.35 0.95 Allowed 'General case' 0 N--CA 1.471 0.611 0 O-C-N 123.333 0.396 . . . . 0.0 110.4 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -90.37 47.16 1.4 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.483 0.659 . . . . 0.0 110.522 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.37 -26.45 30.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.565 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -55.98 -35.64 66.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.359 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.91 -40.52 96.67 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 121.09 -0.244 . . . . 0.0 110.655 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtm -62.14 -46.14 90.31 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.284 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -58.11 -39.72 79.35 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.507 0.505 . . . . 0.0 110.986 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -60.53 -57.56 12.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.153 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.35 68.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -55.24 -58.77 6.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.202 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -71.09 -38.77 72.39 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -60.18 -43.13 96.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.962 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 87.7 mt -65.19 -47.53 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -30.85 68.2 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -59.51 -35.95 75.13 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.531 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mp -67.06 120.34 71.24 Favored Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -88.38 -26.23 0.64 Allowed 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.752 2.968 . . . . 0.0 116.247 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -84.66 -0.22 52.68 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.47 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.4 mt -73.5 132.91 43.42 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.525 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.472 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -50.62 145.49 6.68 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.815 0.697 . . . . 0.0 109.781 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -50.49 -40.3 50.69 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.36 -41.43 85.11 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.686 0.279 . . . . 0.0 111.004 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.472 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -65.23 -39.56 92.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.933 -179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -55.3 -53.75 52.21 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.646 0.26 . . . . 0.0 111.459 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -72.69 -34.03 66.9 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.432 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.68 -59.62 5.09 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -59.0 -47.04 86.62 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 57.1 mt -59.78 -37.32 70.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.214 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -69.72 -37.89 76.71 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.7 m -58.94 -32.86 69.98 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.613 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -51.22 -56.59 12.08 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 120.788 0.328 . . . . 0.0 110.299 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -62.68 -38.62 91.08 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.179 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.96 -36.54 72.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.993 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -161.98 82.9 1.75 Allowed Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 120.647 0.261 . . . . 0.0 111.106 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -56.81 -19.16 30.1 Favored 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.81 2.34 . . . . 0.0 112.919 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 t -57.42 -34.5 68.99 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.095 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -104.86 18.08 22.97 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.105 0.253 . . . . 0.0 111.071 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.8 p -50.82 -39.01 52.13 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -38.98 92.8 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.1 0.476 . . . . 0.0 109.934 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -68.59 -46.31 69.7 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.135 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.9 mt -57.35 -45.71 84.07 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.352 0.408 . . . . 0.0 111.289 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 tp -60.49 -49.38 77.8 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.58 95.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.823 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -64.05 -39.59 94.42 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.654 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.05 95.42 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -64.85 -37.46 87.69 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.398 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -59.6 -43.25 93.77 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.219 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.1 mt -63.18 -43.06 99.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.949 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -61.51 -48.24 81.96 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.261 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.35 -38.4 86.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.506 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.53 -51.52 11.54 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.47 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.0 mt-30 -66.3 -27.86 68.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.93 144.81 56.41 Favored Pre-proline 0 CA--C 1.539 0.529 0 O-C-N 123.157 0.286 . . . . 0.0 111.593 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.31 153.58 50.84 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 122.982 2.454 . . . . 0.0 112.326 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.418 179.817 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -78.27 0.06 Allowed 'General case' 0 CA--C 1.534 0.338 0 O-C-N 123.31 0.381 . . . . 0.0 110.479 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -90.28 -61.01 1.77 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.062 0.226 . . . . 0.0 110.849 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -169.37 149.6 4.09 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.103 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -82.36 51.24 1.78 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.458 0.647 . . . . 0.0 111.777 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.2 -33.55 74.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.198 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -54.95 -49.51 71.18 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.34 0.4 . . . . 0.0 111.802 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.66 -34.34 72.7 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.1 0.476 . . . . 0.0 109.989 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -43.64 97.14 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.949 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.98 -39.23 88.83 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.979 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -61.46 -55.94 25.63 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.846 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.65 74.26 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -55.69 -59.72 4.45 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.622 0.248 . . . . 0.0 111.34 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -71.08 -38.09 72.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.166 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.23 -41.65 89.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.802 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.76 -48.97 80.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.73 -30.6 67.6 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.0 tp -60.33 -36.27 77.56 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.663 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -64.42 120.69 67.35 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -87.83 -27.72 0.52 Allowed 'Trans proline' 0 N--CA 1.504 2.107 0 C-N-CA 123.765 2.977 . . . . 0.0 116.271 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -83.89 -0.5 51.55 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.467 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -72.94 135.98 45.11 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.373 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.476 ' H ' HE21 ' A' ' 26' ' ' GLN . 81.2 m-20 -55.11 144.94 22.25 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.537 0.523 . . . . 0.0 109.973 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -49.66 -41.51 43.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -66.16 -41.42 90.37 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.149 0.281 . . . . 0.0 110.912 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.476 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.7 mt-30 -65.44 -40.3 93.1 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.047 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -55.69 -53.18 59.68 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.738 0.304 . . . . 0.0 111.235 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -70.41 -36.78 74.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.204 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.93 -58.37 8.83 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -58.64 -47.05 85.73 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -61.04 -37.95 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.431 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.6 ttt-85 -68.51 -41.86 79.39 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.4 m -58.97 -34.52 71.9 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.995 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.89 -44.27 78.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.254 0.346 . . . . 0.0 110.543 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -66.94 -42.67 84.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.117 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.95 -39.54 90.54 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.033 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -137.09 77.27 43.23 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.179 0.3 . . . . 0.0 110.465 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.17 -24.27 78.81 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.355 2.036 . . . . 0.0 112.266 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.7 p -61.76 -30.53 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.332 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -90.68 5.27 48.79 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 123.27 0.356 . . . . 0.0 110.905 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 p -40.15 -53.96 2.38 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.87 92.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.277 0.361 . . . . 0.0 110.972 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -67.76 -47.11 70.14 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.184 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.7 mt -58.44 -40.84 83.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.258 0.349 . . . . 0.0 111.046 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.2 tp -61.76 -48.09 82.25 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.07 -43.12 99.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.704 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -62.21 -38.98 91.23 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.682 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.28 96.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -63.45 -36.65 84.46 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.555 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -59.2 -43.89 92.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.377 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.91 -43.81 97.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.029 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.35 -47.99 83.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -61.78 -38.35 87.73 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.533 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.43 -50.93 12.87 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.467 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.9 mt-30 -66.02 -27.85 68.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.18 144.82 58.9 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.192 0.308 . . . . 0.0 111.64 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.2 167.98 8.4 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 122.649 2.233 . . . . 0.0 112.021 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 CA--C 1.547 0.843 0 CA-C-O 117.436 -1.269 . . . . 0.0 110.762 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -74.13 -75.37 0.16 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.34 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.12 -61.3 1.71 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.738 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -171.9 147.97 2.25 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.205 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -79.81 58.0 2.71 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.548 0.69 . . . . 0.0 111.121 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -68.43 -30.13 68.95 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.563 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -54.45 -46.45 73.29 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -62.32 -37.54 85.97 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.469 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.54 -41.76 98.44 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.372 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.89 -39.1 87.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.418 0.449 . . . . 0.0 110.35 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -59.81 -54.84 41.54 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.772 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.9 70.36 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.167 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -54.76 -57.84 9.93 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.692 0.282 . . . . 0.0 111.232 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -69.24 -39.9 78.23 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.83 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -60.92 -40.5 93.4 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.122 0.263 . . . . 0.0 111.111 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 71.6 mt -64.7 -52.08 59.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.33 -29.07 68.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.393 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.18 -32.88 71.49 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.473 0.483 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.34 136.82 75.73 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.186 -178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -90.47 -42.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 123.597 2.864 . . . . 0.0 116.592 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.86 -0.48 57.59 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.457 ' HA ' HE22 ' A' ' 55' ' ' GLN . 95.9 mt -65.48 137.82 57.69 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.672 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.512 ' H ' HE21 ' A' ' 26' ' ' GLN . 65.2 t30 -57.64 157.79 6.76 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -53.01 -51.28 62.17 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.12 -41.02 74.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.512 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.6 mt-30 -59.41 -42.47 91.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -59.78 -50.58 73.27 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.062 0.226 . . . . 0.0 111.003 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 -71.8 -32.08 67.24 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.414 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.02 -47.08 87.32 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -59.64 -53.11 61.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.89 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.0 mt -59.01 -39.87 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 122.977 0.173 . . . . 0.0 110.582 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.4 -43.95 92.79 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 120.968 0.413 . . . . 0.0 109.973 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.4 m -60.67 -32.68 71.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.82 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -46.97 76.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.097 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -64.59 -42.45 95.58 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.482 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.16 -36.9 81.05 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.49 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -151.51 88.41 4.32 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.587 0.232 . . . . 0.0 111.159 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -54.33 -24.92 36.74 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.755 2.303 . . . . 0.0 112.517 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -58.9 -33.6 70.72 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.449 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -86.35 1.23 51.91 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.7 p -40.03 -56.23 1.9 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.78 92.52 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.48 -47.47 66.99 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.594 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 36.8 mt -57.98 -41.5 83.12 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.408 0.443 . . . . 0.0 110.859 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.59 -50.76 71.32 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.89 83.22 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.023 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -61.76 -33.36 73.94 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.596 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -43.79 91.35 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -62.5 -36.41 82.44 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.197 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -63.35 -50.6 69.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.69 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.88 -41.98 99.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.463 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -60.65 -47.47 86.1 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.216 0.322 . . . . 0.0 110.389 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.95 -38.52 91.38 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.114 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.44 -51.42 13.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.457 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.9 mt-30 -66.0 -27.99 68.54 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.77 146.46 66.49 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 123.133 0.271 . . . . 0.0 111.131 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.74 159.93 50.52 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.881 2.387 . . . . 0.0 112.047 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.471 0.624 0 O-C-N 124.018 0.824 . . . . 0.0 110.932 -179.922 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -73.74 -74.96 0.16 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.556 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.44 -61.28 1.71 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.928 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -168.88 144.76 3.44 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.262 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -84.33 52.27 2.3 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.352 0.596 . . . . 0.0 111.093 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -85.22 -0.6 55.15 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.768 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -61.99 -48.59 79.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.074 0.464 . . . . 0.0 109.996 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -63.55 -35.95 82.18 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.123 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.2 mtt -61.69 -40.82 96.36 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.854 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -62.08 -42.65 99.43 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.395 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -59.66 -50.93 71.97 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.731 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.42 -29.71 67.5 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.002 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -56.9 -55.02 39.93 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.518 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -75.3 -36.19 61.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.86 -47.51 83.06 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.94 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.96 -50.39 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.267 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -30.66 64.89 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.543 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -60.13 -36.76 78.22 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.402 0.439 . . . . 0.0 111.822 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.32 119.9 57.15 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -87.71 -22.18 1.6 Allowed 'Trans proline' 0 N--CA 1.503 2.063 0 C-N-CA 123.569 2.846 . . . . 0.0 115.516 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.496 HD22 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -82.62 -6.1 59.17 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.473 ' HA ' HE22 ' A' ' 55' ' ' GLN . 18.9 mt -72.99 131.53 42.27 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.662 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.509 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.5 t-20 -53.2 146.83 10.97 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.965 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -51.76 -41.44 61.61 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.0 -41.93 81.51 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.12 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.509 HE21 ' H ' ' A' ' 23' ' ' ASN . 29.6 mt-30 -63.17 -40.29 97.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.988 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -59.45 -57.72 11.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.762 0.315 . . . . 0.0 110.611 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -62.09 -33.82 75.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.831 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.84 95.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.869 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -60.71 -59.51 5.27 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.7 mt -56.4 -44.58 80.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 123.323 0.39 . . . . 0.0 111.293 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -62.01 -49.2 76.98 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.646 0.26 . . . . 0.0 110.759 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -63.7 -26.45 68.66 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.414 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -47.27 86.32 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.511 0.507 . . . . 0.0 109.759 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.96 -42.81 97.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.875 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.6 -36.69 85.04 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.523 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -137.73 78.64 36.25 Favored Pre-proline 0 CA--C 1.541 0.597 0 O-C-N 123.333 0.396 . . . . 0.0 110.567 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.42 -19.87 66.12 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.406 2.071 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.8 m -61.39 -29.89 70.21 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.055 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -99.2 3.91 46.55 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.2 m -44.1 -40.47 4.94 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -47.11 72.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 110.26 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -63.52 -43.81 96.08 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.894 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -57.95 -40.89 81.64 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.187 0.305 . . . . 0.0 111.015 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.25 -45.88 92.67 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.63 94.73 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.568 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -61.32 -37.96 85.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.878 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.5 94.93 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -62.74 -35.52 80.05 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.744 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.06 -46.87 88.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.569 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.6 mt -63.33 -39.3 94.17 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.496 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -62.56 -48.84 77.73 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.014 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.06 -38.39 88.62 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.095 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.4 -51.13 18.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.938 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.473 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.2 mt-30 -65.96 -27.04 67.86 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.753 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 148.52 29.73 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.126 0.266 . . . . 0.0 111.46 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.42 158.12 58.97 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.787 2.325 . . . . 0.0 112.045 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.02 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.64 -74.06 0.1 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.903 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -89.48 -60.64 1.89 Allowed 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.2 tttp -176.43 153.92 1.24 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.106 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -78.67 55.85 1.74 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.433 0.635 . . . . 0.0 111.872 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -70.79 -31.18 67.86 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.406 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -54.88 -44.5 74.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.52 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -61.68 -38.81 89.17 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.906 0.384 . . . . 0.0 110.26 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.75 -41.07 98.07 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.463 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -60.45 -38.95 85.81 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.33 0.394 . . . . 0.0 110.549 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -62.39 -51.36 67.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.658 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.11 -32.17 71.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.857 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -55.01 -61.48 2.28 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.004 0.43 . . . . 0.0 110.928 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.1 t90 -69.69 -42.01 74.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.686 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -57.93 -45.29 86.78 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.169 0.293 . . . . 0.0 111.282 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.2 -43.89 95.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.19 -28.84 67.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.2 tp -60.78 -36.37 78.8 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 123.357 0.411 . . . . 0.0 111.199 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.26 120.39 61.37 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -88.27 -20.35 1.77 Allowed 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 123.786 2.99 . . . . 0.0 116.289 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.3 p30 -91.42 -0.47 57.64 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.46 ' HA ' HE22 ' A' ' 55' ' ' GLN . 14.8 mt -71.53 137.62 48.25 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.414 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.478 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.0 t30 -57.14 148.63 21.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.031 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -52.55 -38.5 59.97 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.168 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -73.28 -39.45 65.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.33 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.478 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.1 mt-30 -66.28 -45.59 79.95 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -59.09 -43.01 91.8 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -72.37 -40.72 67.07 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.751 0.31 . . . . 0.0 110.764 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.8 97.73 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.243 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -61.8 -54.31 43.97 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.5 mt -60.77 -31.93 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -72.28 -42.76 65.18 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.055 0.455 . . . . 0.0 110.174 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.6 p -62.29 -26.08 68.21 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.438 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -53.51 -46.14 69.99 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.1 -39.75 71.91 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.152 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.79 -42.9 90.15 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.46 0.475 . . . . 0.0 111.963 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 82.59 9.23 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-O 120.872 0.368 . . . . 0.0 110.924 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -56.16 -20.15 30.03 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 122.856 2.371 . . . . 0.0 112.339 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.7 p -63.49 -27.7 69.46 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.735 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -99.58 5.11 46.04 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -43.49 -43.95 5.7 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.15 -46.24 81.68 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.879 0.371 . . . . 0.0 110.516 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.62 -43.93 92.15 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.323 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.39 -42.74 87.75 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.277 0.36 . . . . 0.0 111.028 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.4 tp -60.51 -50.83 71.97 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.46 96.67 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -62.04 -36.49 81.76 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.442 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.69 98.78 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -64.12 -36.09 82.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.685 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -59.83 -44.76 93.88 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.227 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.7 -44.83 96.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.931 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -60.66 -48.56 81.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.544 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.06 -38.42 86.12 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.417 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.03 -51.49 12.22 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.46 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.0 mt-30 -65.48 -27.85 68.79 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.24 145.81 54.93 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 123.155 0.284 . . . . 0.0 111.435 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.98 164.65 26.55 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.862 2.375 . . . . 0.0 111.791 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.398 -0.811 . . . . 0.0 111.112 179.874 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.6 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -89.39 179.54 6.06 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.779 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -53.98 -25.2 19.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.536 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.95 -42.02 2.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.215 0.606 . . . . 0.0 111.953 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -57.02 13.35 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.869 -178.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.8 -41.07 88.16 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -57.99 -59.94 4.49 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -177.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.44 -38.6 87.75 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.576 0.227 . . . . 0.0 111.478 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.0 ttm -61.51 -54.49 42.56 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.273 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.06 -39.1 71.55 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.265 0.353 . . . . 0.0 111.718 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -58.64 -62.77 1.62 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 121.097 -0.241 . . . . 0.0 111.192 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.19 -27.25 67.11 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.73 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -56.53 -59.81 4.44 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.603 0.24 . . . . 0.0 111.07 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -70.58 -39.18 74.02 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.85 -41.49 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.277 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -68.61 -48.78 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.75 -29.38 66.7 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.267 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.57 -36.81 76.94 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.345 0.403 . . . . 0.0 111.332 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.13 121.71 73.39 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -87.6 -21.84 1.72 Allowed 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.57 2.847 . . . . 0.0 116.186 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -91.91 -1.09 57.47 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.456 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.1 mt -70.28 137.09 50.44 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.398 178.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.454 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.6 t-20 -58.64 145.66 39.01 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.38 -40.35 68.09 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -65.7 -45.28 83.39 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.481 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.454 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -63.62 -35.95 82.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.58 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -61.32 -61.76 2.32 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.538 0.524 . . . . 0.0 110.004 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -60.05 -38.18 82.03 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.15 87.65 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -61.58 -60.82 3.11 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.172 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -56.06 -40.06 61.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 123.351 0.407 . . . . 0.0 111.637 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -62.33 -49.84 74.01 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 m -62.36 -32.69 73.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.815 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.72 -44.79 90.53 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.076 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -63.43 -42.75 98.69 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.694 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.72 -36.96 82.46 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.211 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -147.65 86.39 6.29 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.167 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -60.95 -14.82 34.94 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 122.397 2.065 . . . . 0.0 112.253 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 t -57.81 -32.07 67.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.211 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -92.79 2.36 56.79 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.194 0.309 . . . . 0.0 111.415 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 60.7 p -44.32 -49.85 9.3 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.9 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -69.97 -48.8 56.83 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.127 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -58.28 -41.99 85.55 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.206 0.316 . . . . 0.0 110.905 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.4 -48.51 80.91 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.95 -41.18 97.68 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.674 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.14 -39.96 95.14 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.549 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.51 87.64 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -64.07 -38.21 90.25 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -62.58 -43.59 98.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.111 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.16 -47.26 85.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.485 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.4 -48.76 80.4 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.299 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.13 -38.6 83.54 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.067 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -51.28 15.54 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.967 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.456 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.18 -27.91 68.36 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.901 -179.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.37 144.77 50.72 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.259 0.349 . . . . 0.0 111.735 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.96 154.88 42.99 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 123.141 2.561 . . . . 0.0 112.356 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 118.121 -0.942 . . . . 0.0 110.543 179.719 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 51.2 t . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.85 152.39 31.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.15 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -55.25 -23.2 21.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.637 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.1 -39.49 42.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.041 0.536 . . . . 0.0 112.192 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -61.77 2.35 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.135 0.272 . . . . 0.0 111.343 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -63.48 -34.46 77.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.209 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -59.91 -57.35 13.26 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -178.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.6 -41.57 98.32 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.5 tpp -61.08 -48.61 80.92 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.892 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -58.21 -39.92 80.28 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.452 0.47 . . . . 0.0 111.214 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -59.58 -59.59 5.19 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.576 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.29 69.29 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.433 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -54.83 -61.2 2.46 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.867 0.365 . . . . 0.0 111.314 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.3 t90 -66.87 -41.96 86.42 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.781 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -59.67 -43.7 93.86 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.211 0.319 . . . . 0.0 111.352 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.27 -47.7 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.35 -26.36 64.98 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.309 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.24 -32.91 70.4 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 123.436 0.46 . . . . 0.0 111.74 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -57.34 138.45 80.88 Favored Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.816 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -90.13 -43.97 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 123.518 2.812 . . . . 0.0 116.516 -176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -86.8 -2.69 58.77 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -175.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.427 ' HA ' HE22 ' A' ' 55' ' ' GLN . 89.8 mt -66.9 132.25 47.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.294 -0.962 . . . . 0.0 109.143 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.556 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 6.0 m120 -57.0 158.28 5.07 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -56.32 -41.21 75.65 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.797 0.332 . . . . 0.0 111.044 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.69 -41.46 71.95 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.761 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.556 ' NE2' ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -61.22 -42.58 98.85 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.047 -179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.04 -54.41 45.2 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.105 0.478 . . . . 0.0 110.165 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -61.58 -34.69 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.9 71.63 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -60.12 -53.3 59.39 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.471 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.78 -34.06 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.837 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -64.37 -44.48 91.26 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 t -61.5 -31.53 71.53 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.174 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.39 -52.07 60.51 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.6 -39.4 93.63 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.197 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -58.38 -38.62 77.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.999 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.91 105.35 0.72 Allowed Pre-proline 0 CA--C 1.542 0.673 0 O-C-N 123.138 0.274 . . . . 0.0 111.062 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.36 -16.77 56.63 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.836 1.691 . . . . 0.0 111.067 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.2 m -57.57 -33.26 67.97 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.995 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -92.88 -3.05 55.28 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 123.192 0.308 . . . . 0.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.6 t -46.01 -38.04 7.34 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.69 73.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -67.88 -47.86 67.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.157 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -56.12 -43.73 78.44 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.335 0.397 . . . . 0.0 111.018 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.8 tp -61.52 -50.8 71.23 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.04 84.74 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.94 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -62.59 -35.64 80.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.049 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -43.89 97.76 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -62.91 -38.42 90.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.08 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -62.23 -45.09 94.87 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.112 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -44.93 95.35 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.724 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.17 -47.05 86.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.333 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.86 -36.79 82.28 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -52.0 27.6 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.278 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.429 ' NE2' HE22 ' A' ' 26' ' ' GLN . 26.9 mt-30 -72.04 -27.41 62.68 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.69 145.12 63.01 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.104 0.252 . . . . 0.0 111.474 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.6 170.0 4.87 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.694 2.263 . . . . 0.0 112.007 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp . . . . . 0 CA--C 1.548 0.882 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.673 179.801 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -63.46 -74.25 0.1 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -90.13 -34.96 15.68 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -158.23 0.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.576 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -90.73 119.31 30.85 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.231 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -93.31 -38.18 11.64 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.165 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.63 -42.77 75.44 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.813 -178.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -58.32 -38.37 76.99 Favored 'General case' 0 C--O 1.237 0.433 0 O-C-N 123.25 0.344 . . . . 0.0 110.949 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -50.44 67.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.476 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -60.26 -37.04 79.2 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.349 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.6 -60.96 2.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.74 -31.63 72.94 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.288 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -56.01 -60.16 3.88 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.882 0.372 . . . . 0.0 111.038 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -68.76 -42.04 78.02 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.706 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -57.63 -46.85 83.62 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.281 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.5 mt -64.18 -45.98 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.65 -25.23 62.53 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.392 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.17 -37.34 74.53 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.762 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -72.65 120.24 79.6 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.208 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -89.04 -20.93 1.35 Allowed 'Trans proline' 0 N--CA 1.502 2.019 0 C-N-CA 123.666 2.91 . . . . 0.0 115.523 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.2 p30 -83.78 -2.57 56.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.468 ' HA ' HE22 ' A' ' 55' ' ' GLN . 58.2 mt -73.09 130.4 40.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.516 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.52 ' H ' HE21 ' A' ' 26' ' ' GLN . 44.7 t30 -49.89 147.11 4.04 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.815 0.697 . . . . 0.0 110.526 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -47.72 -43.15 26.69 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -68.9 -44.5 73.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.647 0.261 . . . . 0.0 110.938 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.52 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.7 mt-30 -59.88 -38.23 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.186 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -58.01 -56.05 27.07 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -71.64 -31.95 67.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.775 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.19 66.77 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -61.84 -54.25 44.71 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.0 mt -58.85 -43.05 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 123.041 0.213 . . . . 0.0 111.142 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.61 -45.81 92.5 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.908 0.385 . . . . 0.0 110.145 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 m -60.88 -31.65 71.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.553 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -47.44 83.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.425 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.11 -42.01 99.48 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.75 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.31 -35.2 78.31 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.338 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -144.59 83.64 9.61 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 123.126 0.266 . . . . 0.0 110.739 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.99 -24.6 49.43 Favored 'Trans proline' 0 N--CA 1.5 1.91 0 C-N-CA 122.652 2.235 . . . . 0.0 112.508 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -59.67 -30.67 68.93 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.751 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -96.34 5.09 51.68 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -45.41 -38.57 6.13 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.77 73.48 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.806 0.336 . . . . 0.0 110.619 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -67.14 -48.72 67.2 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.482 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.83 -42.65 80.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.172 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.77 -48.97 79.4 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.01 96.98 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.898 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -64.4 -39.76 94.49 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.863 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.19 90.75 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -63.21 -32.86 74.37 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.977 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.19 -46.54 89.39 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.189 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.2 mt -64.45 -38.0 89.49 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.157 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -60.93 -48.5 81.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.872 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.31 -37.58 88.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.147 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.42 -52.3 23.28 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.412 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.468 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.4 mt-30 -70.17 -27.64 64.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.271 -178.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.86 5.27 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 123.272 0.358 . . . . 0.0 111.718 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.42 156.96 9.99 Favored 'Trans proline' 0 N--CA 1.503 2.048 0 C-N-CA 123.15 2.566 . . . . 0.0 113.13 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.1 mmtp . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.414 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -83.06 -170.09 2.85 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.248 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -55.74 -23.04 26.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.007 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.75 -40.53 6.12 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.389 0.431 . . . . 0.0 111.879 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -55.27 28.61 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.456 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -66.38 -38.66 88.03 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -55.02 -66.71 0.36 Allowed 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.56 -38.1 80.21 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.126 0.266 . . . . 0.0 111.704 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.6 ttm -61.0 -52.49 64.8 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.142 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -59.32 -36.41 75.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 123.273 0.358 . . . . 0.0 111.799 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -60.33 -60.94 3.02 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.116 0.26 . . . . 0.0 111.375 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.83 -28.18 66.5 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.463 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -56.39 -61.61 2.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.886 0.374 . . . . 0.0 111.085 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -67.45 -42.03 83.73 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.187 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -60.2 -46.22 90.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.118 0.261 . . . . 0.0 111.569 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.45 -48.33 85.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 121.061 -0.255 . . . . 0.0 110.372 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.8 65.59 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.424 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.3 tp -58.7 -35.93 73.43 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.447 0.467 . . . . 0.0 111.608 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.79 120.85 64.07 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -87.89 -22.08 1.56 Allowed 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 123.721 2.948 . . . . 0.0 116.403 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -89.37 -0.69 57.67 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -177.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.47 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.3 mt -72.95 138.86 46.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.692 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.51 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.9 t-20 -58.25 144.07 42.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.331 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -49.67 -42.69 46.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -68.09 -41.08 82.42 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.095 0.247 . . . . 0.0 111.309 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.51 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.9 mt-30 -63.2 -38.05 89.65 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.157 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -59.17 -60.94 3.06 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 -62.16 -33.5 74.62 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.117 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.983 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -60.17 -61.48 2.58 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.657 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.44 -43.16 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -61.25 -46.86 88.64 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.206 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.7 m -63.88 -33.7 76.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.61 -44.06 96.74 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.707 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -61.62 -40.72 95.84 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.617 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.66 -37.38 83.84 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.848 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.65 96.6 2.97 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.139 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.69 -16.34 52.34 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.089 1.859 . . . . 0.0 111.395 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.4 m -58.1 -32.63 68.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.822 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -89.12 -3.63 58.58 Favored 'General case' 0 C--O 1.225 -0.184 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.217 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 t -46.96 -39.52 12.55 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.26 -45.13 85.8 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.06 -48.07 66.61 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.285 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.9 mt -58.93 -42.69 90.36 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.234 0.334 . . . . 0.0 110.949 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.18 -48.65 80.85 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.057 0.456 . . . . 0.0 109.816 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.0 -43.4 98.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.7 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -61.08 -36.78 80.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.907 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.64 -44.43 90.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -61.9 -35.27 77.86 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.783 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -60.5 -45.47 93.66 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.097 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -65.38 -40.74 93.87 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.025 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -60.59 -48.68 80.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.342 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.63 -38.58 90.81 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.397 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.96 -51.44 13.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.47 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.1 mt-30 -66.43 -27.43 67.83 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.895 -178.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.43 142.97 48.79 Favored Pre-proline 0 N--CA 1.47 0.566 0 CA-C-O 120.846 0.355 . . . . 0.0 111.874 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.92 169.36 7.47 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.44 2.093 . . . . 0.0 112.013 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.645 179.207 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.89 -75.08 0.15 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.399 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -90.65 -61.44 1.67 Allowed 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.212 0.32 . . . . 0.0 110.963 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -168.97 142.92 2.97 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.303 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -83.34 45.79 1.07 Allowed 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.222 0.534 . . . . 0.0 111.375 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.437 HD21 ' H ' ' A' ' 6' ' ' ASN . 1.8 p30 -85.12 -1.74 57.22 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -59.86 -46.53 89.01 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-O 120.945 0.403 . . . . 0.0 110.398 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -62.35 -35.27 78.58 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.149 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 58.2 mtt -62.21 -40.65 96.82 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -62.33 -41.83 98.89 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.72 -50.28 71.71 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.035 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.73 -34.93 77.82 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.04 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -55.48 -51.89 65.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.973 0.416 . . . . 0.0 110.802 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -66.04 -45.7 80.47 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.498 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -60.18 -40.7 90.93 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.743 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.68 -55.34 23.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.06 -31.44 65.21 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.458 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -61.71 -37.42 84.09 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.355 0.41 . . . . 0.0 111.153 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -67.58 121.21 78.18 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -87.2 -34.43 0.13 Allowed 'Trans proline' 0 N--CA 1.502 1.981 0 C-N-CA 123.346 2.698 . . . . 0.0 114.817 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.437 HD22 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -61.84 -20.31 63.53 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.134 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.472 ' HA ' HE22 ' A' ' 55' ' ' GLN . 16.5 mt -65.92 127.35 31.68 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.036 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.465 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.0 t-20 -50.18 147.13 4.37 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.072 0.857 . . . . 0.0 110.089 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -50.38 -39.83 47.84 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.53 -41.85 71.99 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.473 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.465 HE21 ' H ' ' A' ' 23' ' ' ASN . 33.4 mt-30 -61.2 -38.48 86.74 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -54.51 -63.51 1.13 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.923 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -61.52 -33.38 73.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.248 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.82 -59.35 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -61.21 -44.77 96.76 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.63 -42.0 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.098 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 46.5 mmm-85 -77.61 -33.73 53.61 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.504 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.4 p -58.13 -31.82 67.56 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.708 -0.224 . . . . 0.0 110.92 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -41.42 86.06 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.708 0.289 . . . . 0.0 110.395 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -65.35 -44.1 88.75 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.579 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.8 -38.39 81.79 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.556 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.54 88.63 3.95 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.521 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.0 -18.69 64.68 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.292 1.995 . . . . 0.0 111.982 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -60.88 -24.53 66.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.482 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.63 6.65 45.63 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.8 m -41.41 -47.44 3.61 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.84 -44.0 86.84 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -65.56 -44.89 85.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.307 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.8 mt -58.87 -42.55 89.69 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.297 0.373 . . . . 0.0 111.151 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.9 tp -60.82 -47.92 84.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.38 -43.09 99.64 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.669 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -61.75 -37.42 84.21 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.876 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.22 92.22 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -63.03 -36.22 82.85 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.652 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.18 -44.07 92.17 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.02 -43.06 99.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.956 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.437 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -61.07 -47.98 83.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 179.027 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.57 -38.83 88.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.221 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.65 -51.33 17.11 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.161 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.472 HE22 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt-30 -65.95 -27.25 68.02 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.878 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.35 145.74 35.6 Favored Pre-proline 0 N--CA 1.472 0.668 0 O-C-N 123.112 0.257 . . . . 0.0 111.597 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -74.78 153.49 42.97 Favored 'Trans proline' 0 N--CA 1.499 1.826 0 C-N-CA 122.858 2.372 . . . . 0.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.488 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -71.56 -72.88 0.2 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.408 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -90.56 -61.49 1.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.932 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -170.33 149.94 3.49 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.241 0.338 . . . . 0.0 110.189 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -81.0 55.88 2.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.576 0.703 . . . . 0.0 111.181 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -64.83 -34.95 79.58 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.217 179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -54.92 -48.68 72.78 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.507 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -62.73 -34.11 76.52 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.8 ttm -61.72 -47.2 86.35 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.198 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.44 -37.12 82.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.776 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -59.1 -54.81 42.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.952 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.38 68.44 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 121.205 -0.198 . . . . 0.0 111.161 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -55.44 -63.87 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.812 0.339 . . . . 0.0 111.271 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.79 -36.78 78.7 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.843 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -58.68 -42.76 89.28 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.184 -0.207 . . . . 0.0 110.92 -179.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 84.5 mt -65.95 -46.92 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -30.16 66.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.314 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.01 -36.2 76.7 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.296 0.372 . . . . 0.0 111.581 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.01 120.32 62.97 Favored Pre-proline 0 CA--C 1.543 0.673 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -88.48 -26.28 0.61 Allowed 'Trans proline' 0 N--CA 1.502 2.008 0 C-N-CA 123.717 2.945 . . . . 0.0 116.327 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 p30 -85.36 -1.78 57.37 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.2 mt -70.44 139.25 51.73 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.466 ' H ' HE21 ' A' ' 26' ' ' GLN . 21.7 t-20 -55.92 140.67 42.06 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.451 0.469 . . . . 0.0 110.853 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -45.9 -40.08 9.6 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -70.36 -45.07 66.82 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.238 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.466 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -60.59 -38.14 83.65 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.129 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -54.93 -55.84 26.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.476 0.179 . . . . 0.0 111.31 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.3 mtt85 -71.1 -33.31 70.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.216 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.75 -57.9 10.91 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -59.74 -46.0 90.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.23 -39.53 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -67.55 -42.22 83.0 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.881 0.372 . . . . 0.0 110.175 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -60.08 -35.15 74.54 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.035 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.41 -51.31 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 123.356 0.41 . . . . 0.0 110.761 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.85 -42.52 97.56 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.973 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.63 -37.76 85.18 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.674 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -142.17 79.31 16.15 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 123.159 0.287 . . . . 0.0 110.965 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -55.35 -25.09 46.06 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.79 2.327 . . . . 0.0 112.534 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -59.92 -31.27 69.67 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.464 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -91.94 4.11 53.72 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.256 0.347 . . . . 0.0 111.405 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.5 p -40.02 -55.28 2.09 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.78 -39.0 92.85 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.123 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -68.4 -49.21 61.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.48 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.27 -41.42 79.68 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.286 0.366 . . . . 0.0 111.15 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -61.86 -49.7 75.2 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.39 96.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.821 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -63.34 -38.3 90.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.585 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.69 -42.47 95.31 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -63.25 -36.13 82.65 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.584 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -59.73 -44.52 93.74 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.147 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.4 mt -62.92 -42.78 99.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.976 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -60.95 -48.23 82.77 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.338 178.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -62.05 -38.59 89.32 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.435 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.92 -51.46 12.4 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.476 HE22 ' HA ' ' A' ' 22' ' ' LEU . 17.4 mt-30 -66.32 -27.88 68.25 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.75 150.91 24.77 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.179 0.3 . . . . 0.0 111.601 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.67 153.61 69.15 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 122.927 2.418 . . . . 0.0 112.224 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.8 mptt . . . . . 0 C--O 1.221 -0.404 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.4 -179.866 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 60.9 t . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -69.29 -73.19 0.16 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.02 -61.23 1.73 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 109.984 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -173.72 152.54 2.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.231 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -80.38 65.79 5.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.537 0.684 . . . . 0.0 111.279 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -86.65 -7.02 58.68 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.71 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -61.9 -52.81 62.58 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 120.747 0.308 . . . . 0.0 111.053 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -61.11 -33.99 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.538 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.13 -42.94 99.61 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -62.73 -38.88 92.24 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -63.31 -52.77 60.55 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.131 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.42 74.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.037 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -55.97 -56.06 25.27 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.994 0.426 . . . . 0.0 110.988 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -69.97 -43.37 71.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.657 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -58.45 -47.93 82.38 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.277 0.361 . . . . 0.0 111.476 -178.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -63.58 -49.64 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.19 -30.47 66.47 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.523 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -60.52 -36.03 77.39 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.86 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.03 120.4 63.73 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.206 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -87.84 -18.22 2.45 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.606 2.871 . . . . 0.0 115.672 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.502 HD22 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -87.83 -5.19 58.73 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -177.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -74.03 132.08 42.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.792 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.485 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.3 t-20 -54.89 151.5 8.58 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.985 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -54.47 -39.93 67.95 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.78 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -71.65 -45.55 61.65 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.068 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.485 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.5 mt-30 -61.26 -45.15 95.69 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.071 -178.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.05 -52.18 66.46 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.174 0.296 . . . . 0.0 111.11 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -66.21 -33.84 76.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.271 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.77 96.73 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.18 -0.463 . . . . 0.0 112.172 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -61.29 -62.07 2.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.8 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.5 mt -56.21 -41.85 71.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 123.119 0.262 . . . . 0.0 111.527 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -62.79 -51.01 68.78 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 120.964 0.411 . . . . 0.0 110.306 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 89.5 p -64.05 -23.9 67.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.245 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -46.51 89.68 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -64.3 -44.47 91.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.371 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -61.41 -38.27 86.48 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.303 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -135.59 81.54 41.6 Favored Pre-proline 0 CA--C 1.549 0.909 0 O-C-N 123.398 0.436 . . . . 0.0 110.347 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -63.18 -17.46 60.25 Favored 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 121.909 1.739 . . . . 0.0 112.461 -179.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.7 p -65.2 -26.59 68.2 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.23 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -101.96 4.44 39.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.7 m -45.05 -38.91 5.26 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.31 -45.98 74.9 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.702 0.286 . . . . 0.0 110.346 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.68 -46.06 80.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.7 -41.24 81.3 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.336 0.397 . . . . 0.0 111.014 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.9 tp -61.08 -49.02 79.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.9 99.56 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.821 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -61.37 -39.31 90.17 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.841 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.46 97.42 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -65.3 -35.67 81.72 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.711 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -59.39 -47.35 85.77 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.54 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -63.66 -38.16 90.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.19 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.502 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.77 -48.67 78.14 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.869 178.817 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.21 -38.54 89.55 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.14 -51.25 18.63 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.092 -178.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.466 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.7 mt-30 -66.29 -26.18 67.2 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.912 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.31 145.9 34.49 Favored Pre-proline 0 N--CA 1.471 0.611 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.16 153.5 46.29 Favored 'Trans proline' 0 N--CA 1.498 1.78 0 C-N-CA 122.926 2.417 . . . . 0.0 112.376 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 89.7 mttt . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.524 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -75.12 0.09 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -89.89 -60.93 1.8 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -173.02 152.64 2.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.172 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 15.0 p90 -79.23 58.65 2.59 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.488 0.661 . . . . 0.0 112.099 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.95 -29.81 65.93 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.204 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.32 -43.87 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.252 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.99 -40.13 92.32 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.4 mtt -64.4 -38.68 91.87 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.163 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -59.76 -40.0 86.69 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.308 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -64.33 -54.99 24.39 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.53 -34.0 76.82 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.933 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -57.88 -57.55 12.3 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.856 0.36 . . . . 0.0 111.439 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -68.99 -44.95 71.82 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.436 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -59.44 -46.4 88.84 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.606 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.55 -42.85 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.296 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.22 -32.57 70.08 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.084 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.54 -33.76 76.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.719 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -61.99 119.12 45.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 122.958 0.161 . . . . 0.0 111.115 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -89.59 -42.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 123.583 2.855 . . . . 0.0 114.796 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.86 -36.82 75.22 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.442 ' HA ' HE22 ' A' ' 55' ' ' GLN . 8.6 mp -63.62 130.43 44.25 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.326 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.404 ' H ' HE21 ' A' ' 26' ' ' GLN . 62.7 t30 -51.12 146.94 5.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.407 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -53.78 -38.07 64.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.652 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.64 -43.04 99.81 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.364 0.415 . . . . 0.0 110.457 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.404 HE21 ' H ' ' A' ' 23' ' ' ASN . 34.6 mt-30 -65.65 -43.48 89.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.361 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -62.68 -50.93 69.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.578 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -62.06 -40.97 97.59 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.681 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.61 -34.46 77.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.791 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -63.41 -59.07 5.16 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.175 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.417 HG22 HD12 ' A' ' 31' ' ' ILE . 63.6 mt -61.74 -32.99 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.704 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.09 -46.36 71.2 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.216 0.532 . . . . 0.0 109.683 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 96.5 p -64.99 -21.93 66.92 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.993 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -48.64 80.86 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -66.35 -41.8 89.02 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.716 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.76 -36.82 84.29 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.385 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -147.66 78.6 9.86 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.228 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.61 -27.73 85.35 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.544 2.163 . . . . 0.0 112.437 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 m -58.99 -30.34 67.9 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.703 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.8 5.76 44.68 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.5 t -45.51 -38.09 5.97 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.3 0.5 . . . . 0.0 111.777 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.06 -46.52 70.84 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.319 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -66.88 -45.84 76.83 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.11 -41.66 79.39 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.546 0.529 . . . . 0.0 110.99 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.72 -49.21 75.97 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.59 81.97 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.839 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -62.5 -32.88 73.87 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.488 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.13 -41.75 90.04 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -61.44 -35.21 76.96 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.891 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.42 -51.31 66.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.03 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.51 -39.46 94.49 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.045 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -56.64 -47.93 78.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.08 -31.88 72.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.389 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -53.12 34.69 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.442 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.8 mt-30 -80.89 -26.24 36.97 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.73 157.17 8.06 Favored Pre-proline 0 N--CA 1.472 0.667 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.94 159.05 4.13 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 123.0 2.467 . . . . 0.0 112.464 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt . . . . . 0 CA--C 1.546 0.819 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.604 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.46 -71.06 0.19 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.018 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -90.06 -61.61 1.65 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.314 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -174.25 148.62 1.31 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.351 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -83.54 48.25 1.39 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.311 0.577 . . . . 0.0 111.314 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -84.84 -2.05 57.25 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.993 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -60.19 -48.19 82.76 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.966 0.413 . . . . 0.0 110.348 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.87 -35.03 77.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.319 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.9 mtt -62.04 -41.55 98.24 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.246 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -62.33 -42.94 99.79 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.348 0.405 . . . . 0.0 109.926 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -61.92 -50.3 72.71 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.35 -31.77 71.4 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.017 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -56.19 -56.62 18.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.819 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.73 -41.28 79.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.069 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -58.67 -42.88 89.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 121.176 -0.209 . . . . 0.0 111.451 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.32 -52.2 55.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.98 68.1 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.402 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.2 tp -60.59 -36.48 78.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.598 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.12 119.67 71.6 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -88.18 -24.22 1.02 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 123.651 2.901 . . . . 0.0 115.69 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.519 HD22 ' ND2' ' A' ' 52' ' ' ASN . 2.0 p30 -80.6 -6.3 58.09 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.479 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.6 mt -71.7 132.2 44.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.941 -0.703 . . . . 0.0 109.202 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.471 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.2 t30 -51.73 151.96 3.11 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.712 0.633 . . . . 0.0 110.926 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -50.95 -40.79 58.26 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -74.93 -48.04 26.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.849 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.471 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.2 mt-30 -59.73 -45.7 91.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.226 -178.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 ttmm -56.59 -47.36 79.74 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.287 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -79.54 -32.13 42.14 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.873 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -45.56 91.54 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -59.24 -58.63 7.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.544 -0.462 . . . . 0.0 112.054 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -54.94 -46.05 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 O-C-N 123.094 0.246 . . . . 0.0 111.557 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -62.88 -47.24 84.16 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.767 0.318 . . . . 0.0 110.547 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -61.22 -30.61 70.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.002 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -44.89 92.58 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.07 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.24 -39.53 94.14 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.575 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -67.14 -38.45 85.57 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.706 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -140.06 74.82 30.35 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.225 0.328 . . . . 0.0 110.454 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.87 -16.41 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 112.428 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.2 m -61.48 -29.71 70.14 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.15 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.435 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 51.2 mm-40 -105.06 9.71 34.27 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.8 m -44.29 -35.08 2.16 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.21 69.39 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.204 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.435 ' ND2' ' HB3' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -71.0 -37.03 72.66 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.24 -178.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.08 -44.46 96.63 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.64 -48.43 81.81 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.74 91.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.846 178.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -63.72 -37.24 86.61 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.806 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.31 93.81 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -63.5 -35.65 81.17 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.943 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -59.13 -47.99 83.26 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.571 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.32 -38.84 92.72 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.174 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.519 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.52 -48.26 80.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.885 178.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.46 -38.48 89.99 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.086 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.28 -51.26 15.8 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.479 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.2 mt-30 -65.37 -26.84 68.19 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.37 157.31 4.97 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.15 0.281 . . . . 0.0 111.672 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.2 156.51 5.27 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 123.101 2.534 . . . . 0.0 112.954 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.883 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.7 t . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.7 138.55 58.54 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -54.21 -23.21 13.76 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.613 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -25.36 17.42 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -85.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -52.04 -35.73 48.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.14 -67.08 0.42 Allowed 'General case' 0 C--O 1.24 0.574 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -61.1 -39.26 89.27 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.498 ' SD ' ' CD2' ' A' ' 34' ' ' LEU . 1.6 mmm -62.8 -43.27 99.23 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.932 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -60.18 -40.11 88.84 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.293 0.37 . . . . 0.0 110.571 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -59.64 -55.85 29.26 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.305 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.68 -29.99 66.44 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -57.24 -59.67 4.76 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.867 0.365 . . . . 0.0 111.179 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -67.85 -42.55 81.22 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.121 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.25 -46.44 89.79 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.129 0.268 . . . . 0.0 111.52 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.48 -47.44 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.274 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.4 -29.38 66.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.533 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -59.88 -36.73 77.54 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 123.264 0.352 . . . . 0.0 111.471 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 120.98 69.4 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -86.88 -34.44 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.258 2.639 . . . . 0.0 114.652 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.461 HD22 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -64.42 -19.29 65.43 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.461 ' HA ' HE22 ' A' ' 55' ' ' GLN . 13.1 mt -64.0 132.1 49.6 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.938 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.458 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.7 t-20 -55.58 143.18 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -50.23 -39.14 43.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -67.03 -43.95 81.48 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.86 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.458 HE21 ' H ' ' A' ' 23' ' ' ASN . 32.7 mt-30 -62.5 -36.96 84.17 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.883 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -59.31 -62.94 1.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 110.694 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.29 -34.94 74.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.15 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.15 -48.45 81.56 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.412 0.445 . . . . 0.0 111.986 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.56 -61.43 2.59 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.253 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.413 HG22 HD13 ' A' ' 31' ' ' ILE . 51.4 mt -54.51 -39.42 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 O-C-N 123.336 0.397 . . . . 0.0 111.963 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.84 -50.49 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.7 m -63.53 -34.93 78.87 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.829 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' CD2' ' SD ' ' A' ' 9' ' ' MET . 3.9 tt -59.11 -42.22 90.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.955 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -63.11 -45.42 92.09 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.53 -36.76 85.25 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.452 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -139.14 82.0 20.21 Favored Pre-proline 0 CA--C 1.545 0.761 0 O-C-N 123.334 0.396 . . . . 0.0 111.521 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.7 -17.38 49.26 Favored 'Trans proline' 0 N--CA 1.505 2.149 0 C-N-CA 122.499 2.132 . . . . 0.0 111.993 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.7 m -57.26 -33.78 67.96 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.288 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -91.62 -0.59 57.59 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 123.187 0.304 . . . . 0.0 111.521 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.6 t -46.11 -37.78 7.28 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 117.694 0.224 . . . . 0.0 111.579 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -45.51 70.5 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -66.82 -47.27 72.53 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.051 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.52 -40.45 82.93 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.305 0.378 . . . . 0.0 110.752 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 15.4 tp -61.02 -49.04 79.01 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.703 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -61.44 -38.16 86.15 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.655 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.1 96.43 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 tttt -64.52 -37.57 88.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.161 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -60.65 -44.3 96.59 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.794 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.1 mt -62.45 -44.57 96.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.508 178.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.461 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -59.5 -48.14 82.79 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.401 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.25 -37.95 84.95 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.036 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.01 17.42 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.954 -178.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.461 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.1 mt-30 -65.34 -27.25 68.46 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.894 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -52.92 151.76 8.11 Favored Pre-proline 0 N--CA 1.475 0.777 0 O-C-N 123.213 0.321 . . . . 0.0 111.835 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.4 170.41 4.22 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.742 2.294 . . . . 0.0 112.152 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.7 mttt . . . . . 0 N--CA 1.477 0.913 0 O-C-N 124.285 0.991 . . . . 0.0 110.778 179.96 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 40.9 t . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -71.63 -74.1 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.489 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -90.31 -61.29 1.71 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.245 0.341 . . . . 0.0 110.801 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -169.32 146.4 3.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.097 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -80.02 71.0 6.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.48 0.657 . . . . 0.0 111.127 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -88.26 -5.44 58.36 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.6 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -62.23 -51.13 68.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.73 0.3 . . . . 0.0 110.798 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -61.25 -34.13 74.65 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.67 -42.92 99.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.432 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.44 -38.74 92.3 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -63.59 -53.89 44.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.766 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -31.83 72.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.057 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -56.72 -56.11 25.56 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.02 0.438 . . . . 0.0 110.594 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -68.38 -44.58 74.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.588 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.35 -42.05 94.9 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.0 mt -65.01 -49.78 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.37 -25.13 61.69 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.17 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.02 -37.68 74.77 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.356 0.41 . . . . 0.0 111.98 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -69.93 119.9 74.44 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -89.01 -20.73 1.39 Allowed 'Trans proline' 0 N--CA 1.5 1.899 0 C-N-CA 123.208 2.605 . . . . 0.0 115.134 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 p30 -86.97 -2.57 58.72 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.446 ' HA ' HE22 ' A' ' 55' ' ' GLN . 39.8 mt -71.36 135.13 47.16 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.387 178.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.466 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -51.33 143.64 11.13 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.586 0.554 . . . . 0.0 110.095 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -47.97 -39.96 20.99 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.403 0.439 . . . . 0.0 112.152 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.65 -44.4 74.19 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.023 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.466 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.5 mt-30 -62.68 -36.95 84.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.111 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -57.55 -56.78 17.43 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.666 0.269 . . . . 0.0 110.973 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -68.71 -34.53 75.8 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.182 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.61 -52.41 63.89 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -59.45 -61.25 2.76 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 120.422 -0.511 . . . . 0.0 112.118 -178.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.7 -41.67 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.188 0.305 . . . . 0.0 111.657 -178.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.0 ttt-85 -63.28 -49.28 74.68 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.924 0.392 . . . . 0.0 110.175 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 57.1 m -61.19 -30.22 70.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.024 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.14 -43.86 92.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.061 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -66.17 -41.95 89.6 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.011 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -43.11 88.41 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.876 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -135.94 74.51 57.03 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.018 0.437 . . . . 0.0 110.638 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -60.68 -11.03 15.75 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.486 2.124 . . . . 0.0 113.11 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.4 p -62.02 -25.08 67.45 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.83 16.81 19.4 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -48.56 -37.24 17.32 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.86 -45.23 90.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.425 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -64.3 -47.17 80.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.113 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.81 -41.86 78.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.408 0.443 . . . . 0.0 111.267 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.56 -49.99 75.34 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.03 99.74 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.764 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -59.92 -38.08 81.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.864 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -47.76 81.01 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -62.53 -37.78 87.43 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.336 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -60.2 -45.29 93.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.272 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 mt -64.87 -39.8 94.13 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -60.02 -49.1 79.0 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.429 0.456 . . . . 0.0 110.307 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.63 -38.87 89.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.265 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.51 -51.37 14.93 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.446 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.1 mt-30 -65.45 -27.94 68.87 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.614 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.34 145.0 59.96 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.288 0.367 . . . . 0.0 111.467 -179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.47 151.62 47.92 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.923 2.415 . . . . 0.0 112.261 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt . . . . . 0 C--O 1.223 -0.329 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.408 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.86 -79.78 0.05 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.265 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -89.73 -60.96 1.8 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.09 0.244 . . . . 0.0 110.636 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -172.11 146.36 1.92 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.102 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -81.33 51.77 1.69 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.458 0.647 . . . . 0.0 111.044 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -56.28 -29.23 60.89 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.562 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.0 -35.31 64.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.511 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.569 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -40.84 97.36 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.507 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -58.49 -41.29 84.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.457 0.473 . . . . 0.0 110.806 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -63.22 -54.97 29.07 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.146 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.55 78.24 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.291 -179.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -55.89 -53.01 61.94 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.904 0.383 . . . . 0.0 111.153 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.4 t90 -67.54 -46.38 72.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.219 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.41 -43.5 96.65 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.846 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 93.2 mt -64.74 -48.96 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -31.34 68.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.304 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.51 -35.96 77.2 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.295 0.372 . . . . 0.0 111.531 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -67.67 120.24 71.95 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -88.62 -26.92 0.49 Allowed 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 123.663 2.908 . . . . 0.0 116.297 -178.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -83.71 -0.66 51.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -176.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.477 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.0 mt -72.28 135.21 45.92 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.319 178.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.462 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.4 t-20 -54.11 142.84 24.15 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.654 0.596 . . . . 0.0 110.234 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -47.6 -42.63 24.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -66.61 -41.47 88.34 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.287 0.367 . . . . 0.0 111.383 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.462 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.98 -41.36 95.51 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.063 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -52.99 -54.38 35.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.717 0.294 . . . . 0.0 111.172 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -71.43 -36.05 71.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.401 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.83 -55.37 36.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -60.25 -54.13 49.4 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.9 mt -58.22 -41.1 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.188 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -64.81 -48.03 75.88 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.04 0.447 . . . . 0.0 109.999 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.2 t -61.81 -24.99 67.22 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.361 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.14 -43.94 98.11 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.649 0.593 . . . . 0.0 109.52 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -67.18 -39.9 86.5 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -64.6 -30.63 71.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.339 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -144.74 76.62 13.96 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 120.771 0.319 . . . . 0.0 110.683 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -54.42 -31.41 68.27 Favored 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.987 2.458 . . . . 0.0 112.698 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -59.36 -28.45 66.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.203 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -92.74 1.88 57.04 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.2 t -44.02 -41.66 5.57 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.69 -46.0 76.99 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.667 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -67.18 -46.11 74.95 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.181 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -57.73 -43.45 85.34 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.159 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.7 tp -60.92 -49.87 75.72 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.38 97.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.804 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -62.57 -39.02 92.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.348 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -40.95 97.13 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -63.81 -36.38 83.71 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.586 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -59.81 -44.31 94.05 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.15 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.54 -43.09 99.67 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.1 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.24 -48.38 81.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.29 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -61.76 -38.42 87.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.494 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.47 -51.55 11.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.477 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.5 mt-30 -65.8 -27.92 68.63 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 146.04 56.64 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.166 0.291 . . . . 0.0 111.485 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.82 153.76 58.77 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.997 2.465 . . . . 0.0 112.22 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mttp . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.484 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.5 148.7 47.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.097 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -54.67 -22.38 13.55 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.528 -179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -24.63 17.06 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.447 ' CD2' ' CE ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -63.91 -62.55 1.57 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.518 0.199 . . . . 0.0 111.529 -179.135 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -58.65 -36.43 74.12 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.71 -55.28 37.09 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.98 -43.19 99.47 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.362 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.447 ' CE ' ' CD2' ' A' ' 5' ' ' PHE . 0.2 OUTLIER -63.17 -44.72 94.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.967 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -57.68 -41.43 81.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.318 0.387 . . . . 0.0 111.05 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -61.01 -57.14 13.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.465 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -30.33 68.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.456 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.37 -58.99 5.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.895 0.379 . . . . 0.0 110.97 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -65.74 -43.26 89.49 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.652 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -59.91 -50.75 72.56 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.186 0.303 . . . . 0.0 111.27 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 89.7 mt -63.57 -47.08 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 120.575 0.226 . . . . 0.0 110.484 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.41 -29.42 64.11 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.64 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -60.65 -36.98 80.04 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.241 0.338 . . . . 0.0 111.641 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.32 120.02 61.31 Favored Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -88.85 -26.18 0.55 Allowed 'Trans proline' 0 N--CA 1.503 2.038 0 C-N-CA 123.696 2.931 . . . . 0.0 116.28 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -84.62 -0.44 53.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.475 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.6 mt -72.84 135.65 45.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.579 178.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.482 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.9 t-20 -53.89 143.52 21.15 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.698 0.624 . . . . 0.0 110.136 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -47.85 -40.74 22.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -68.8 -43.13 76.26 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.684 0.278 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.482 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.6 mt-30 -63.81 -37.73 88.48 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.273 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -56.36 -55.07 38.03 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.733 0.302 . . . . 0.0 111.279 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm180 -72.21 -31.9 66.27 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.494 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.1 -50.34 73.1 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.4 -55.41 31.8 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.417 HD11 HG21 ' A' ' 31' ' ' ILE . 49.2 mt -56.79 -38.34 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 122.966 0.166 . . . . 0.0 111.31 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 mmm-85 -65.94 -42.29 90.24 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.5 t -61.89 -30.58 70.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.084 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.51 -51.07 63.99 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.781 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.27 -39.51 94.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -56.98 -38.08 72.52 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.599 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.92 104.62 1.15 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 121.165 -0.214 . . . . 0.0 111.19 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.18 -17.39 59.54 Favored 'Trans proline' 0 N--CA 1.502 1.971 0 C-N-CA 121.898 1.732 . . . . 0.0 111.69 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.3 p -59.52 -30.71 68.77 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -96.39 1.14 51.49 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.124 0.265 . . . . 0.0 111.461 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.3 p -43.7 -51.82 6.88 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.54 91.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.744 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -69.11 -49.06 60.5 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.295 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.2 mt -56.72 -45.09 82.09 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.495 0.497 . . . . 0.0 110.923 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.99 -52.21 66.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.27 86.68 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.056 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -62.54 -37.72 87.22 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.261 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.64 95.65 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -63.54 -35.47 80.58 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.783 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -59.64 -47.14 86.77 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.342 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.9 mt -63.36 -39.74 95.36 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.335 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -61.3 -48.43 81.43 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.316 0.385 . . . . 0.0 110.114 178.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -62.4 -38.68 90.6 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.312 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.34 -51.56 12.88 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.475 HE22 ' HA ' ' A' ' 22' ' ' LEU . 18.7 mt-30 -66.35 -27.93 68.27 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.23 146.44 61.97 Favored Pre-proline 0 CA--C 1.537 0.466 0 O-C-N 123.206 0.316 . . . . 0.0 111.327 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.18 158.8 55.16 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.846 2.364 . . . . 0.0 111.989 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt . . . . . 0 CA--C 1.541 0.609 0 O-C-N 124.059 0.85 . . . . 0.0 110.923 -179.975 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 44.4 t . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -71.13 -72.32 0.22 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.56 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -90.42 -61.5 1.67 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.213 0.32 . . . . 0.0 111.075 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -171.25 149.43 2.8 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.185 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -82.88 52.3 2.12 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.523 0.678 . . . . 0.0 111.349 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -59.22 -30.8 68.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.312 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -55.32 -34.6 64.31 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.333 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.28 -44.22 97.59 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.361 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -38.73 92.22 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -59.21 -39.22 81.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.63 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -65.26 -55.24 19.54 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.057 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.8 -34.96 79.07 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.949 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -56.57 -52.95 62.88 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.214 0.531 . . . . 0.0 110.625 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -62.53 -46.01 90.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.775 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -61.09 -42.31 98.27 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -178.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.3 mt -62.34 -53.86 41.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 120.638 0.256 . . . . 0.0 110.421 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.83 -30.58 67.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.37 -37.14 79.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 123.242 0.339 . . . . 0.0 111.203 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.65 120.8 68.92 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.14 -21.6 1.57 Allowed 'Trans proline' 0 N--CA 1.504 2.134 0 C-N-CA 123.824 3.016 . . . . 0.0 116.236 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -89.85 -0.15 57.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -176.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.8 mt -74.89 138.37 42.39 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.85 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.501 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.3 t-20 -60.94 145.93 48.65 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.834 178.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -51.38 -42.38 61.35 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.06 -37.95 81.86 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.221 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.501 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.3 mt-30 -67.32 -53.96 24.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -56.34 -48.58 76.49 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.68 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.9 mtt85 -63.25 -33.44 75.51 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.763 178.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.66 -55.64 16.42 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -60.0 -41.2 91.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.146 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 mm -57.05 -42.3 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -72.55 -35.69 68.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.194 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -57.51 -33.66 68.29 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.508 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.72 -53.6 37.58 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.168 0.292 . . . . 0.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.16 -39.69 95.39 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.051 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.26 -40.86 95.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.503 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -151.31 82.92 5.63 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 123.243 0.339 . . . . 0.0 110.332 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.76 -24.97 80.18 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.411 2.074 . . . . 0.0 112.13 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -59.6 -33.15 71.1 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.172 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -88.76 8.69 27.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.439 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.3 p -43.35 -48.74 6.97 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.94 95.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.696 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.35 -47.26 61.84 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.294 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -58.14 -43.97 87.6 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.314 0.384 . . . . 0.0 110.857 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.78 -49.08 78.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.14 -41.92 97.6 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.881 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -62.89 -37.69 87.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.824 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.27 90.75 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -63.17 -36.31 83.21 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.624 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -58.54 -43.7 89.36 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.352 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.6 mt -63.11 -41.98 99.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.988 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -62.68 -47.81 82.05 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.326 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -61.76 -37.86 85.85 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.348 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.78 -50.69 14.49 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.476 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.0 mt-30 -67.88 -27.46 66.68 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 -178.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 158.48 5.58 Favored Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.19 155.8 11.36 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.151 2.567 . . . . 0.0 112.993 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.3 mptt . . . . . 0 CA--C 1.534 0.357 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.414 -179.871 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -67.58 -65.83 0.64 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.21 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -91.3 -60.55 1.86 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 mttp 179.65 158.11 0.66 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.265 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -84.97 43.63 1.01 Allowed 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.378 0.609 . . . . 0.0 111.301 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -63.62 -37.44 87.35 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.538 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -53.61 -49.48 67.74 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.077 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -61.97 -41.82 98.44 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.742 -179.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.415 ' SD ' ' HB3' ' A' ' 38' ' ' PRO . 73.7 mtm -64.26 -37.05 86.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.878 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -61.04 -39.8 91.19 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -61.75 -43.47 98.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.953 179.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.05 -40.13 87.05 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.259 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -48.93 76.94 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.566 179.908 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -61.37 -44.41 97.21 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -61.36 -39.93 92.45 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 82.0 mt -60.97 -52.77 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.279 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.31 -31.42 67.49 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.424 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.99 -35.76 77.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.573 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.466 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -70.26 121.71 84.05 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.495 -179.282 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -87.34 -22.81 1.59 Allowed 'Trans proline' 0 N--CA 1.507 2.268 0 C-N-CA 123.823 3.015 . . . . 0.0 115.259 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.95 79.98 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -177.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' CD1' ' HB3' ' A' ' 19' ' ' LEU . 4.1 mp -73.01 132.31 43.23 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.977 0.417 . . . . 0.0 111.025 -178.714 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.454 ' H ' HE21 ' A' ' 26' ' ' GLN . 0.2 OUTLIER -55.36 156.98 3.97 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.101 179.857 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -57.07 -42.13 80.04 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.305 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -43.92 96.1 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.859 -179.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.454 HE21 ' H ' ' A' ' 23' ' ' ASN . 35.4 mt-30 -62.99 -39.06 93.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.71 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -58.4 -64.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.935 -179.384 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -59.58 -34.22 72.44 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.721 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.24 -43.77 95.79 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.281 0.363 . . . . 0.0 111.53 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -63.54 -52.52 60.77 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.93 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.0 mm -56.41 -46.03 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -61.49 -47.79 84.03 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 120.679 0.276 . . . . 0.0 110.358 179.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.8 t -62.34 -30.46 71.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.246 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.18 -51.47 69.6 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.449 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -62.28 -40.52 96.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.678 179.086 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.77 -40.05 93.81 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.116 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -136.76 82.89 31.01 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.668 -179.357 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HB3' ' SD ' ' A' ' 9' ' ' MET . 51.7 Cg_exo -53.49 -28.23 44.01 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.869 2.379 . . . . 0.0 112.424 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.5 -35.01 73.32 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.008 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -82.66 -1.47 51.21 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.0 p -41.31 -54.43 3.0 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.74 92.35 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -67.95 -50.22 57.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.745 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -57.05 -40.76 77.43 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 123.091 0.244 . . . . 0.0 111.15 -178.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.4 tp -61.49 -50.3 73.29 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.732 179.164 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.18 89.83 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.824 178.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -62.19 -36.5 82.1 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.58 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.58 -39.66 91.85 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -63.68 -39.65 94.84 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.609 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.83 -51.89 66.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.37 -36.3 83.57 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -49.11 78.79 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.371 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -63.68 -37.03 85.79 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.729 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.7 -52.25 13.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -177.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.435 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.5 mt-30 -68.31 -25.88 65.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 -179.052 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.52 149.45 39.79 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 123.06 0.225 . . . . 0.0 111.085 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.93 155.01 62.85 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 122.776 2.318 . . . . 0.0 112.272 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? . . . . . 0 N--CA 1.476 0.83 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.865 179.921 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.02 -40.12 72.95 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.44 -179.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.43 -41.78 90.34 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.666 0.269 . . . . 0.0 110.7 179.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 tttp -69.35 -51.75 33.89 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.945 179.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -24.69 67.72 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -91.74 -61.51 1.62 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.97 -47.42 83.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -57.96 -46.49 85.01 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 120.803 0.335 . . . . 0.0 111.115 -178.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -50.3 72.32 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.48 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -55.78 -41.55 74.22 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 123.569 0.543 . . . . 0.0 111.61 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -58.42 -61.89 2.25 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.501 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.29 -23.52 64.76 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.294 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -58.71 -58.93 6.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . 0.449 ' CD1' ' C ' ' A' ' 14' ' ' TRP . 0.4 OUTLIER -73.58 -35.45 65.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.515 -178.937 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.68 -47.46 85.55 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.198 0.311 . . . . 0.0 110.793 -179.286 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.58 -49.92 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.832 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.0 -24.94 42.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.773 -178.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.1 tp -56.7 -39.03 73.12 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.359 0.412 . . . . 0.0 111.899 -179.044 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -68.73 120.89 78.83 Favored Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -179.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -89.19 -9.94 4.18 Favored 'Trans proline' 0 N--CA 1.504 2.119 0 C-N-CA 123.597 2.865 . . . . 0.0 115.671 -178.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.4 p30 -95.84 -1.43 49.53 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.44 ' HA ' HE22 ' A' ' 55' ' ' GLN . 29.2 mt -75.25 130.36 38.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.69 178.759 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.433 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.8 t-20 -53.89 148.12 10.96 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.628 0.58 . . . . 0.0 109.612 179.158 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -53.05 -44.0 67.07 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -65.54 -42.17 92.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.177 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.433 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.0 mt-30 -65.22 -48.2 74.18 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.303 -179.428 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -61.34 -49.13 78.2 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 123.303 0.377 . . . . 0.0 110.688 -179.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.74 -39.51 91.84 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.641 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.03 -44.44 95.92 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.156 -179.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -60.31 -56.93 15.53 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.649 -179.145 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.1 mt -57.89 -44.19 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 123.162 0.289 . . . . 0.0 110.978 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.7 ttt-85 -62.17 -50.02 73.5 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.843 0.354 . . . . 0.0 110.616 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 t -58.15 -29.31 65.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -45.61 91.46 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -64.12 -39.74 94.68 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.368 178.686 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -59.81 -36.29 76.47 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.05 92.68 2.58 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.82 -179.843 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.98 -18.68 51.63 Favored 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.381 2.054 . . . . 0.0 111.901 179.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.1 p -59.43 -25.32 64.24 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.811 -179.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -102.26 0.87 35.07 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.3 m -46.1 -39.74 9.86 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.78 84.1 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -67.3 -48.05 68.78 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.28 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.1 mt -57.46 -43.01 83.65 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.233 0.333 . . . . 0.0 111.056 -179.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.0 -50.96 71.69 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.26 0.553 . . . . 0.0 109.687 179.083 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.0 -41.33 96.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.04 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -63.72 -38.12 89.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.776 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.62 -44.69 93.19 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -63.49 -32.96 74.55 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.05 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -60.27 -47.47 85.85 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.953 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.8 mt -63.82 -37.11 86.15 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.004 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -62.66 -48.77 77.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.988 178.928 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.52 -38.75 91.18 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.88 -51.58 15.74 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.161 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.44 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.5 -27.5 67.83 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.067 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.48 145.44 48.74 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 123.237 0.335 . . . . 0.0 111.588 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.28 154.71 41.41 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 123.084 2.523 . . . . 0.0 112.476 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.392 179.805 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -73.74 -74.52 0.18 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.386 -179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -89.93 -60.99 1.79 Allowed 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.255 0.347 . . . . 0.0 110.583 179.856 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -173.1 151.86 2.19 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -83.24 56.26 3.46 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 110.867 179.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -59.88 -28.12 67.27 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.629 179.747 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -55.16 -37.49 67.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.589 -178.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -62.95 -40.03 96.42 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.669 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -39.36 93.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.555 179.308 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -59.28 -43.59 92.51 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 123.378 0.424 . . . . 0.0 110.649 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -62.75 -50.83 69.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.268 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.05 78.34 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.139 -179.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -55.8 -55.82 27.87 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.969 0.414 . . . . 0.0 110.895 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -64.98 -45.66 84.73 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.442 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -58.61 -49.48 77.32 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.511 -178.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 85.6 mt -57.76 -50.17 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.662 0.268 . . . . 0.0 110.877 179.621 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.57 -25.42 64.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.935 -179.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.81 -38.28 84.86 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.238 0.336 . . . . 0.0 110.889 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.58 121.11 75.72 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.016 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.75 -8.05 5.25 Favored 'Trans proline' 0 N--CA 1.503 2.031 0 C-N-CA 123.592 2.862 . . . . 0.0 115.587 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -98.97 -2.3 37.73 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.929 0.714 . . . . 0.0 112.929 -177.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' HA ' HE22 ' A' ' 55' ' ' GLN . 30.3 mt -75.98 130.9 39.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.451 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.533 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -52.28 145.61 10.65 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.199 179.407 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -50.79 -41.0 56.74 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.806 -178.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.59 -42.11 83.03 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.926 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.533 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.8 mt-30 -62.31 -42.18 99.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.697 -179.053 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm -55.42 -63.8 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.632 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -58.21 -32.24 68.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.247 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.77 -62.31 1.89 Allowed 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.174 0.297 . . . . 0.0 111.209 -179.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -61.55 -40.29 94.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.086 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.4 -39.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.291 179.025 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -75.1 -39.31 60.79 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.571 178.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.3 m -55.0 -35.45 64.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.544 -179.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.33 -43.98 71.7 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.248 0.342 . . . . 0.0 110.527 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -68.43 -41.01 80.97 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.173 178.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.22 -41.89 94.03 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.098 -178.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.17 85.21 6.98 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 120.862 0.363 . . . . 0.0 111.098 -179.349 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -54.83 -23.73 35.23 Favored 'Trans proline' 0 N--CA 1.502 1.988 0 C-N-CA 122.908 2.405 . . . . 0.0 112.755 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.7 p -61.91 -27.76 69.04 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.809 -179.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -96.13 8.01 44.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -178.666 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m -44.78 -40.87 6.45 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -178.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -45.39 75.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.788 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -67.52 -48.29 67.47 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.705 -179.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -57.33 -45.53 84.17 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.225 0.328 . . . . 0.0 111.291 -178.75 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.2 tp -60.1 -49.34 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.34 -40.5 94.49 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.817 178.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -64.17 -38.98 92.99 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 179.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.55 -46.55 82.32 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.558 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -63.27 -32.2 73.54 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.046 179.306 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.2 -44.44 95.11 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.897 179.112 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.7 mt -63.21 -39.42 94.57 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.906 178.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -62.98 -49.14 75.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.247 178.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.42 -38.61 90.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.256 -179.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.52 -51.62 14.19 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.455 HE22 ' HA ' ' A' ' 22' ' ' LEU . 26.3 mt-30 -66.2 -27.34 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.132 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 145.33 60.13 Favored Pre-proline 0 CA--C 1.539 0.524 0 O-C-N 123.227 0.329 . . . . 0.0 111.266 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -74.74 153.45 43.14 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 122.895 2.396 . . . . 0.0 112.42 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.44 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -61.68 -40.01 93.44 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.406 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 12.6 mtt -66.0 -39.56 90.38 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.753 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -58.01 -45.1 87.44 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.502 0.501 . . . . 0.0 110.742 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.43 -51.31 68.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.91 68.26 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.109 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.98 -64.89 0.78 Allowed 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.796 0.331 . . . . 0.0 110.769 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -71.06 -36.23 72.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.91 -40.73 81.09 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.995 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.67 -44.73 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.89 64.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.157 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.15 -37.63 80.69 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.938 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.505 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.5 mm? -66.02 120.87 72.86 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 120.32 -0.552 . . . . 0.0 109.877 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.37 -7.89 5.66 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.665 2.91 . . . . 0.0 115.78 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -99.18 -2.17 37.46 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.4 mt -74.51 133.26 42.32 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.314 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -53.09 146.8 10.68 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.067 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -51.96 -40.7 61.28 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -68.24 -42.51 79.61 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.95 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.493 HE22 HD22 ' A' ' 51' ' ' LEU . 90.7 mt-30 -64.17 -43.37 95.35 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.716 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -57.15 -48.0 79.77 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.54 0.21 . . . . 0.0 111.16 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.31 -35.85 68.74 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.62 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.14 -56.77 17.91 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -59.95 -45.81 91.43 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.796 -0.361 . . . . 0.0 111.947 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.8 mt -58.6 -38.66 72.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.664 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -74.24 -32.53 63.01 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -58.23 -33.22 69.11 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.842 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -52.64 -50.27 63.5 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -63.27 -39.19 93.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.112 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.28 -38.28 79.77 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.701 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.46 84.53 2.55 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 120.859 0.361 . . . . 0.0 110.728 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.07 -25.22 44.1 Favored 'Trans proline' 0 N--CA 1.502 1.976 0 C-N-CA 122.834 2.356 . . . . 0.0 112.631 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.6 p -60.41 -30.91 69.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.556 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -92.08 8.83 36.0 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.171 0.295 . . . . 0.0 111.767 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.0 p -43.65 -50.86 7.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.45 92.95 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.322 0.389 . . . . 0.0 110.895 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -70.37 -49.62 47.31 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -57.0 -44.82 83.17 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.319 0.387 . . . . 0.0 111.054 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.9 tp -60.2 -48.64 80.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.96 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.81 -43.37 98.99 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -61.22 -38.89 88.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.939 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.92 88.4 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -63.1 -32.42 73.79 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.943 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -60.77 -43.66 97.75 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.84 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.493 HD22 HE22 ' A' ' 26' ' ' GLN . 58.4 mt -62.82 -39.67 95.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.802 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.42 -49.83 72.21 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.093 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.56 -38.57 90.57 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.21 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -51.55 15.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -65.83 -27.27 68.12 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.28 145.33 57.74 Favored Pre-proline 0 CA--C 1.54 0.558 0 O-C-N 123.144 0.278 . . . . 0.0 111.277 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.39 170.03 5.83 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.515 2.144 . . . . 0.0 111.805 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 CA--C 1.547 0.864 0 CA-C-O 117.565 -1.207 . . . . 0.0 110.606 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 111.359 0.133 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.91 -40.52 96.67 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 121.09 -0.244 . . . . 0.0 110.655 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtm -62.14 -46.14 90.31 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.284 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -58.11 -39.72 79.35 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.507 0.505 . . . . 0.0 110.986 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -60.53 -57.56 12.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.153 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.35 68.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 31' ' ' ILE . 40.1 t80 -55.24 -58.77 6.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.202 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -71.09 -38.77 72.39 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -60.18 -43.13 96.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.962 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 87.7 mt -65.19 -47.53 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -30.85 68.2 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -59.51 -35.95 75.13 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.531 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mp -67.06 120.34 71.24 Favored Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -88.38 -26.23 0.64 Allowed 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.752 2.968 . . . . 0.0 116.247 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -84.66 -0.22 52.68 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.5 132.91 43.42 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.525 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -50.62 145.49 6.68 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.815 0.697 . . . . 0.0 109.781 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -50.49 -40.3 50.69 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -67.36 -41.43 85.11 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.686 0.279 . . . . 0.0 111.004 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.623 HE22 HD22 ' A' ' 51' ' ' LEU . 90.0 mt-30 -65.23 -39.56 92.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.933 -179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -55.3 -53.75 52.21 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.646 0.26 . . . . 0.0 111.459 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -72.69 -34.03 66.9 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.432 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.68 -59.62 5.09 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -59.0 -47.04 86.62 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.413 HG23 ' CD2' ' A' ' 13' ' ' TYR . 57.1 mt -59.78 -37.32 70.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.214 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -69.72 -37.89 76.71 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.7 m -58.94 -32.86 69.98 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.613 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 34' ' ' LEU . 1.9 mm? -51.22 -56.59 12.08 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 120.788 0.328 . . . . 0.0 110.299 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -62.68 -38.62 91.08 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.179 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.96 -36.54 72.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.993 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -161.98 82.9 1.75 Allowed Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 120.647 0.261 . . . . 0.0 111.106 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -56.81 -19.16 30.1 Favored 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.81 2.34 . . . . 0.0 112.919 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 t -57.42 -34.5 68.99 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.095 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -104.86 18.08 22.97 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.105 0.253 . . . . 0.0 111.071 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.8 p -50.82 -39.01 52.13 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -38.98 92.8 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.1 0.476 . . . . 0.0 109.934 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -68.59 -46.31 69.7 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.135 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.9 mt -57.35 -45.71 84.07 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.352 0.408 . . . . 0.0 111.289 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 tp -60.49 -49.38 77.8 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.58 95.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.823 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -64.05 -39.59 94.42 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.654 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.05 95.42 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -64.85 -37.46 87.69 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.398 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -59.6 -43.25 93.77 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.219 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.623 HD22 HE22 ' A' ' 26' ' ' GLN . 82.1 mt -63.18 -43.06 99.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.949 179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -61.51 -48.24 81.96 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.261 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.35 -38.4 86.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.506 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.53 -51.52 11.54 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -66.3 -27.86 68.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.93 144.81 56.41 Favored Pre-proline 0 CA--C 1.539 0.529 0 O-C-N 123.157 0.286 . . . . 0.0 111.593 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.31 153.58 50.84 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 122.982 2.454 . . . . 0.0 112.326 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.418 179.817 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.66 -34.34 72.7 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.1 0.476 . . . . 0.0 109.989 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -43.64 97.14 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.949 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.98 -39.23 88.83 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.979 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -61.46 -55.94 25.63 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.846 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.65 74.26 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -55.69 -59.72 4.45 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.622 0.248 . . . . 0.0 111.34 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -71.08 -38.09 72.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.166 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.23 -41.65 89.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.802 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.76 -48.97 80.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.73 -30.6 67.6 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.0 tp -60.33 -36.27 77.56 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.663 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -64.42 120.69 67.35 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -87.83 -27.72 0.52 Allowed 'Trans proline' 0 N--CA 1.504 2.107 0 C-N-CA 123.765 2.977 . . . . 0.0 116.271 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -83.89 -0.5 51.55 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.2 mt -72.94 135.98 45.11 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.373 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -55.11 144.94 22.25 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.537 0.523 . . . . 0.0 109.973 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -49.66 -41.51 43.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -66.16 -41.42 90.37 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.149 0.281 . . . . 0.0 110.912 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.692 HE22 HD22 ' A' ' 51' ' ' LEU . 90.5 mt-30 -65.44 -40.3 93.1 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.047 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -55.69 -53.18 59.68 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.738 0.304 . . . . 0.0 111.235 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -70.41 -36.78 74.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.204 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.93 -58.37 8.83 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -58.64 -47.05 85.73 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -61.04 -37.95 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.431 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.6 ttt-85 -68.51 -41.86 79.39 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.4 m -58.97 -34.52 71.9 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.995 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.408 ' HG ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -55.89 -44.27 78.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.254 0.346 . . . . 0.0 110.543 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -66.94 -42.67 84.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.117 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.95 -39.54 90.54 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.033 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -137.09 77.27 43.23 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.179 0.3 . . . . 0.0 110.465 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.17 -24.27 78.81 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.355 2.036 . . . . 0.0 112.266 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.7 p -61.76 -30.53 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.332 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -90.68 5.27 48.79 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 123.27 0.356 . . . . 0.0 110.905 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 p -40.15 -53.96 2.38 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.87 92.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.277 0.361 . . . . 0.0 110.972 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -67.76 -47.11 70.14 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.184 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.408 HD12 ' HG ' ' A' ' 34' ' ' LEU . 91.7 mt -58.44 -40.84 83.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.258 0.349 . . . . 0.0 111.046 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.2 tp -61.76 -48.09 82.25 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.07 -43.12 99.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.704 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -62.21 -38.98 91.23 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.682 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.28 96.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -63.45 -36.65 84.46 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.555 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -59.2 -43.89 92.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.377 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.692 HD22 HE22 ' A' ' 26' ' ' GLN . 77.9 mt -62.91 -43.81 97.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -61.35 -47.99 83.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -61.78 -38.35 87.73 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.533 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.43 -50.93 12.87 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -66.02 -27.85 68.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.18 144.82 58.9 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.192 0.308 . . . . 0.0 111.64 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.2 167.98 8.4 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 122.649 2.233 . . . . 0.0 112.021 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 CA--C 1.547 0.843 0 CA-C-O 117.436 -1.269 . . . . 0.0 110.762 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.2 tptt . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -62.32 -37.54 85.97 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.469 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.54 -41.76 98.44 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.372 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.89 -39.1 87.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.418 0.449 . . . . 0.0 110.35 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -59.81 -54.84 41.54 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.772 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.9 70.36 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.167 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -54.76 -57.84 9.93 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.692 0.282 . . . . 0.0 111.232 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -69.24 -39.9 78.23 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.83 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -60.92 -40.5 93.4 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.122 0.263 . . . . 0.0 111.111 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 71.6 mt -64.7 -52.08 59.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.33 -29.07 68.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.393 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.18 -32.88 71.49 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.473 0.483 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.0 OUTLIER -56.34 136.82 75.73 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.186 -178.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -90.47 -42.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 123.597 2.864 . . . . 0.0 116.592 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.86 -0.48 57.59 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.451 HD11 HD12 ' A' ' 19' ' ' LEU . 95.9 mt -65.48 137.82 57.69 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.672 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -57.64 157.79 6.76 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -53.01 -51.28 62.17 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.12 -41.02 74.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.41 -42.47 91.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -59.78 -50.58 73.27 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.062 0.226 . . . . 0.0 111.003 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 -71.8 -32.08 67.24 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.414 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.02 -47.08 87.32 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -59.64 -53.11 61.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.89 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.0 mt -59.01 -39.87 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 122.977 0.173 . . . . 0.0 110.582 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.4 -43.95 92.79 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 120.968 0.413 . . . . 0.0 109.973 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.4 m -60.67 -32.68 71.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.82 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -46.97 76.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.097 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -64.59 -42.45 95.58 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.482 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.16 -36.9 81.05 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.49 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -151.51 88.41 4.32 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.587 0.232 . . . . 0.0 111.159 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -54.33 -24.92 36.74 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.755 2.303 . . . . 0.0 112.517 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -58.9 -33.6 70.72 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.449 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -86.35 1.23 51.91 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.7 p -40.03 -56.23 1.9 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.78 92.52 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.48 -47.47 66.99 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.594 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 36.8 mt -57.98 -41.5 83.12 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.408 0.443 . . . . 0.0 110.859 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.59 -50.76 71.32 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.89 83.22 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.023 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -61.76 -33.36 73.94 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.596 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -43.79 91.35 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -62.5 -36.41 82.44 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.197 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -63.35 -50.6 69.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.69 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.88 -41.98 99.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.463 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.627 ' HB2' HD13 ' A' ' 19' ' ' LEU . 4.4 t30 -60.65 -47.47 86.1 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.216 0.322 . . . . 0.0 110.389 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.95 -38.52 91.38 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.114 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.44 -51.42 13.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -66.0 -27.99 68.54 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.77 146.46 66.49 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 123.133 0.271 . . . . 0.0 111.131 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.74 159.93 50.52 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.881 2.387 . . . . 0.0 112.047 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.471 0.624 0 O-C-N 124.018 0.824 . . . . 0.0 110.932 -179.922 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp . . . . . 0 C--O 1.237 0.441 0 CA-C-O 121.074 0.464 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -63.55 -35.95 82.18 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.123 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.2 mtt -61.69 -40.82 96.36 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.854 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -62.08 -42.65 99.43 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.395 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -59.66 -50.93 71.97 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.731 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.42 -29.71 67.5 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.002 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE2' HD13 ' A' ' 31' ' ' ILE . 55.9 t80 -56.9 -55.02 39.93 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.518 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -75.3 -36.19 61.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.86 -47.51 83.06 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.94 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.96 -50.39 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.267 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -30.66 64.89 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.543 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -60.13 -36.76 78.22 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.402 0.439 . . . . 0.0 111.822 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.32 119.9 57.15 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -87.71 -22.18 1.6 Allowed 'Trans proline' 0 N--CA 1.503 2.063 0 C-N-CA 123.569 2.846 . . . . 0.0 115.516 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -82.62 -6.1 59.17 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -177.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.9 mt -72.99 131.53 42.27 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.662 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.2 146.83 10.97 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.965 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -51.76 -41.44 61.61 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.0 -41.93 81.51 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.12 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.675 HE22 HD22 ' A' ' 51' ' ' LEU . 93.2 mt-30 -63.17 -40.29 97.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.988 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -59.45 -57.72 11.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.762 0.315 . . . . 0.0 110.611 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -62.09 -33.82 75.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.831 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.84 95.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.869 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -60.71 -59.51 5.27 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.447 HD13 ' CE2' ' A' ' 13' ' ' TYR . 71.7 mt -56.4 -44.58 80.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 123.323 0.39 . . . . 0.0 111.293 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -62.01 -49.2 76.98 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.646 0.26 . . . . 0.0 110.759 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -63.7 -26.45 68.66 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.414 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -47.27 86.32 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.511 0.507 . . . . 0.0 109.759 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.96 -42.81 97.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.875 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.6 -36.69 85.04 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.523 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -137.73 78.64 36.25 Favored Pre-proline 0 CA--C 1.541 0.597 0 O-C-N 123.333 0.396 . . . . 0.0 110.567 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.42 -19.87 66.12 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.406 2.071 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.8 m -61.39 -29.89 70.21 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.055 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -99.2 3.91 46.55 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.2 m -44.1 -40.47 4.94 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -47.11 72.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 110.26 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -63.52 -43.81 96.08 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.894 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -57.95 -40.89 81.64 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.187 0.305 . . . . 0.0 111.015 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.25 -45.88 92.67 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.63 94.73 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.568 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -61.32 -37.96 85.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.878 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.5 94.93 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -62.74 -35.52 80.05 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.744 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.06 -46.87 88.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.569 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.675 HD22 HE22 ' A' ' 26' ' ' GLN . 15.6 mt -63.33 -39.3 94.17 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.56 -48.84 77.73 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.014 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.06 -38.39 88.62 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.095 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.4 -51.13 18.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.938 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -65.96 -27.04 67.86 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.753 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 148.52 29.73 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.126 0.266 . . . . 0.0 111.46 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.42 158.12 58.97 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.787 2.325 . . . . 0.0 112.045 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.02 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm . . . . . 0 N--CA 1.471 0.617 0 CA-C-O 120.507 0.194 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -61.68 -38.81 89.17 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.906 0.384 . . . . 0.0 110.26 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.75 -41.07 98.07 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.463 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -60.45 -38.95 85.81 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.33 0.394 . . . . 0.0 110.549 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -62.39 -51.36 67.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.658 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.11 -32.17 71.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.857 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -55.01 -61.48 2.28 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.004 0.43 . . . . 0.0 110.928 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.1 t90 -69.69 -42.01 74.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.686 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -57.93 -45.29 86.78 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.169 0.293 . . . . 0.0 111.282 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.2 -43.89 95.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.19 -28.84 67.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.2 tp -60.78 -36.37 78.8 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 123.357 0.411 . . . . 0.0 111.199 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.26 120.39 61.37 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -88.27 -20.35 1.77 Allowed 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 123.786 2.99 . . . . 0.0 116.289 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.3 p30 -91.42 -0.47 57.64 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 mt -71.53 137.62 48.25 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.414 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -57.14 148.63 21.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.031 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -52.55 -38.5 59.97 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.168 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -73.28 -39.45 65.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.33 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.469 HE22 HD22 ' A' ' 51' ' ' LEU . 92.0 mt-30 -66.28 -45.59 79.95 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -59.09 -43.01 91.8 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -72.37 -40.72 67.07 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.751 0.31 . . . . 0.0 110.764 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.8 97.73 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.243 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -61.8 -54.31 43.97 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.5 mt -60.77 -31.93 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -72.28 -42.76 65.18 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.055 0.455 . . . . 0.0 110.174 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.6 p -62.29 -26.08 68.21 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.438 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.418 HD22 HD13 ' A' ' 44' ' ' LEU . 1.4 mm? -53.51 -46.14 69.99 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 178.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.1 -39.75 71.91 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.152 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.79 -42.9 90.15 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.46 0.475 . . . . 0.0 111.963 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 82.59 9.23 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-O 120.872 0.368 . . . . 0.0 110.924 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -56.16 -20.15 30.03 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 122.856 2.371 . . . . 0.0 112.339 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.7 p -63.49 -27.7 69.46 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.735 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -99.58 5.11 46.04 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -43.49 -43.95 5.7 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.15 -46.24 81.68 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.879 0.371 . . . . 0.0 110.516 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.62 -43.93 92.15 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.323 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.418 HD13 HD22 ' A' ' 34' ' ' LEU . 82.9 mt -58.39 -42.74 87.75 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.277 0.36 . . . . 0.0 111.028 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.4 tp -60.51 -50.83 71.97 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.46 96.67 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -62.04 -36.49 81.76 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.442 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.69 98.78 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -64.12 -36.09 82.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.685 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -59.83 -44.76 93.88 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.227 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.469 HD22 HE22 ' A' ' 26' ' ' GLN . 85.4 mt -60.7 -44.83 96.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.931 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -60.66 -48.56 81.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.544 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.06 -38.42 86.12 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.417 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.03 -51.49 12.22 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.48 -27.85 68.79 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.24 145.81 54.93 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 123.155 0.284 . . . . 0.0 111.435 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.98 164.65 26.55 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.862 2.375 . . . . 0.0 111.791 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.398 -0.811 . . . . 0.0 111.112 179.874 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.44 -38.6 87.75 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.576 0.227 . . . . 0.0 111.478 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.0 ttm -61.51 -54.49 42.56 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.273 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.06 -39.1 71.55 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.265 0.353 . . . . 0.0 111.718 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -58.64 -62.77 1.62 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 121.097 -0.241 . . . . 0.0 111.192 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.19 -27.25 67.11 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.73 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -56.53 -59.81 4.44 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.603 0.24 . . . . 0.0 111.07 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -70.58 -39.18 74.02 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.85 -41.49 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.277 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -68.61 -48.78 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.75 -29.38 66.7 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.267 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.57 -36.81 76.94 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.345 0.403 . . . . 0.0 111.332 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.13 121.71 73.39 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -87.6 -21.84 1.72 Allowed 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.57 2.847 . . . . 0.0 116.186 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -91.91 -1.09 57.47 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.1 mt -70.28 137.09 50.44 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.398 178.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -58.64 145.66 39.01 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.38 -40.35 68.09 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -65.7 -45.28 83.39 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.481 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -63.62 -35.95 82.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.58 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -61.32 -61.76 2.32 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.538 0.524 . . . . 0.0 110.004 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -60.05 -38.18 82.03 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.15 87.65 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -61.58 -60.82 3.11 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.172 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -56.06 -40.06 61.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 123.351 0.407 . . . . 0.0 111.637 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -62.33 -49.84 74.01 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 m -62.36 -32.69 73.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.815 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.72 -44.79 90.53 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.076 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -63.43 -42.75 98.69 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.694 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.72 -36.96 82.46 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.211 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -147.65 86.39 6.29 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.167 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -60.95 -14.82 34.94 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 122.397 2.065 . . . . 0.0 112.253 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 t -57.81 -32.07 67.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.211 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -92.79 2.36 56.79 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.194 0.309 . . . . 0.0 111.415 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 60.7 p -44.32 -49.85 9.3 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.9 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -69.97 -48.8 56.83 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.127 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -58.28 -41.99 85.55 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.206 0.316 . . . . 0.0 110.905 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.4 -48.51 80.91 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.95 -41.18 97.68 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.674 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.14 -39.96 95.14 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.549 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.51 87.64 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -64.07 -38.21 90.25 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -62.58 -43.59 98.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.111 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.16 -47.26 85.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.485 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.4 -48.76 80.4 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.299 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.13 -38.6 83.54 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.067 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -51.28 15.54 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.967 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -66.18 -27.91 68.36 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.901 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.37 144.77 50.72 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.259 0.349 . . . . 0.0 111.735 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.96 154.88 42.99 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 123.141 2.561 . . . . 0.0 112.356 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 118.121 -0.942 . . . . 0.0 110.543 179.719 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.1 tptm . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.6 -41.57 98.32 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.437 ' SD ' HD12 ' A' ' 34' ' ' LEU . 3.5 tpp -61.08 -48.61 80.92 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.892 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -58.21 -39.92 80.28 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.452 0.47 . . . . 0.0 111.214 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -59.58 -59.59 5.19 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.576 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.29 69.29 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.433 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -54.83 -61.2 2.46 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.867 0.365 . . . . 0.0 111.314 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.3 t90 -66.87 -41.96 86.42 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.781 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -59.67 -43.7 93.86 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.211 0.319 . . . . 0.0 111.352 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.27 -47.7 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.35 -26.36 64.98 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.309 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.24 -32.91 70.4 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 123.436 0.46 . . . . 0.0 111.74 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.1 mt -57.34 138.45 80.88 Favored Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.816 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -90.13 -43.97 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 123.518 2.812 . . . . 0.0 116.516 -176.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -86.8 -2.69 58.77 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -175.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.505 HD11 HD12 ' A' ' 19' ' ' LEU . 89.8 mt -66.9 132.25 47.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.294 -0.962 . . . . 0.0 109.143 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -57.0 158.28 5.07 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.834 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -56.32 -41.21 75.65 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.797 0.332 . . . . 0.0 111.044 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.69 -41.46 71.95 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.761 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -61.22 -42.58 98.85 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.047 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.04 -54.41 45.2 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.105 0.478 . . . . 0.0 110.165 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -61.58 -34.69 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.9 71.63 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -60.12 -53.3 59.39 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.471 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.78 -34.06 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.837 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -64.37 -44.48 91.26 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 t -61.5 -31.53 71.53 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.174 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -53.39 -52.07 60.51 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.201 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.6 -39.4 93.63 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.197 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -58.38 -38.62 77.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.999 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.91 105.35 0.72 Allowed Pre-proline 0 CA--C 1.542 0.673 0 O-C-N 123.138 0.274 . . . . 0.0 111.062 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.36 -16.77 56.63 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.836 1.691 . . . . 0.0 111.067 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.2 m -57.57 -33.26 67.97 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.995 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -92.88 -3.05 55.28 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 123.192 0.308 . . . . 0.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.6 t -46.01 -38.04 7.34 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.69 73.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -67.88 -47.86 67.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.157 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.439 HD12 HD22 ' A' ' 34' ' ' LEU . 53.3 mt -56.12 -43.73 78.44 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.335 0.397 . . . . 0.0 111.018 -178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.8 tp -61.52 -50.8 71.23 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.04 84.74 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.94 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -62.59 -35.64 80.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.049 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -43.89 97.76 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -62.91 -38.42 90.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.08 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -62.23 -45.09 94.87 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.112 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -44.93 95.35 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.724 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.594 ' HB2' HD13 ' A' ' 19' ' ' LEU . 1.7 t30 -59.17 -47.05 86.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.333 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.86 -36.79 82.28 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -52.0 27.6 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.278 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.437 HE22 ' HA ' ' A' ' 22' ' ' LEU . 26.9 mt-30 -72.04 -27.41 62.68 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.69 145.12 63.01 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.104 0.252 . . . . 0.0 111.474 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.6 170.0 4.87 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.694 2.263 . . . . 0.0 112.007 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp . . . . . 0 CA--C 1.548 0.882 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.673 179.801 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -58.32 -38.37 76.99 Favored 'General case' 0 C--O 1.237 0.433 0 O-C-N 123.25 0.344 . . . . 0.0 110.949 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -50.44 67.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.476 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -60.26 -37.04 79.2 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.349 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.6 -60.96 2.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.74 -31.63 72.94 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.288 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -56.01 -60.16 3.88 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.882 0.372 . . . . 0.0 111.038 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -68.76 -42.04 78.02 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.706 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -57.63 -46.85 83.62 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.281 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.5 mt -64.18 -45.98 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.65 -25.23 62.53 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.392 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.17 -37.34 74.53 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.762 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.455 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.2 mm? -72.65 120.24 79.6 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.208 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -89.04 -20.93 1.35 Allowed 'Trans proline' 0 N--CA 1.502 2.019 0 C-N-CA 123.666 2.91 . . . . 0.0 115.523 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.2 p30 -83.78 -2.57 56.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 mt -73.09 130.4 40.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.516 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -49.89 147.11 4.04 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.815 0.697 . . . . 0.0 110.526 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -47.72 -43.15 26.69 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -68.9 -44.5 73.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.647 0.261 . . . . 0.0 110.938 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.626 HE22 HD22 ' A' ' 51' ' ' LEU . 95.0 mt-30 -59.88 -38.23 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.186 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -58.01 -56.05 27.07 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -71.64 -31.95 67.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.775 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.19 66.77 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -61.84 -54.25 44.71 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.0 mt -58.85 -43.05 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 123.041 0.213 . . . . 0.0 111.142 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.61 -45.81 92.5 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.908 0.385 . . . . 0.0 110.145 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 m -60.88 -31.65 71.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.553 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -47.44 83.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.425 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.11 -42.01 99.48 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.75 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.31 -35.2 78.31 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.338 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -144.59 83.64 9.61 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 123.126 0.266 . . . . 0.0 110.739 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.99 -24.6 49.43 Favored 'Trans proline' 0 N--CA 1.5 1.91 0 C-N-CA 122.652 2.235 . . . . 0.0 112.508 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -59.67 -30.67 68.93 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.751 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -96.34 5.09 51.68 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -45.41 -38.57 6.13 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.77 73.48 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.806 0.336 . . . . 0.0 110.619 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -67.14 -48.72 67.2 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.482 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.83 -42.65 80.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.172 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.77 -48.97 79.4 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.01 96.98 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.898 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -64.4 -39.76 94.49 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.863 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.19 90.75 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -63.21 -32.86 74.37 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.977 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.19 -46.54 89.39 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.189 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.626 HD22 HE22 ' A' ' 26' ' ' GLN . 6.2 mt -64.45 -38.0 89.49 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.157 178.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.93 -48.5 81.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.872 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.31 -37.58 88.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.147 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.42 -52.3 23.28 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.412 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -70.17 -27.64 64.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.271 -178.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.86 5.27 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 123.272 0.358 . . . . 0.0 111.718 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.42 156.96 9.99 Favored 'Trans proline' 0 N--CA 1.503 2.048 0 C-N-CA 123.15 2.566 . . . . 0.0 113.13 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.1 mmtp . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.414 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.2 mttt . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.56 -38.1 80.21 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.126 0.266 . . . . 0.0 111.704 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.6 ttm -61.0 -52.49 64.8 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.142 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -59.32 -36.41 75.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 123.273 0.358 . . . . 0.0 111.799 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -60.33 -60.94 3.02 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.116 0.26 . . . . 0.0 111.375 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.83 -28.18 66.5 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.463 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -56.39 -61.61 2.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.886 0.374 . . . . 0.0 111.085 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -67.45 -42.03 83.73 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.187 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -60.2 -46.22 90.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.118 0.261 . . . . 0.0 111.569 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.45 -48.33 85.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 121.061 -0.255 . . . . 0.0 110.372 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.8 65.59 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.424 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.3 tp -58.7 -35.93 73.43 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.447 0.467 . . . . 0.0 111.608 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.79 120.85 64.07 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -87.89 -22.08 1.56 Allowed 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 123.721 2.948 . . . . 0.0 116.403 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -89.37 -0.69 57.67 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -177.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.3 mt -72.95 138.86 46.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.692 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -58.25 144.07 42.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.331 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -49.67 -42.69 46.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -68.09 -41.08 82.42 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.095 0.247 . . . . 0.0 111.309 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.566 HE22 HD22 ' A' ' 51' ' ' LEU . 96.2 mt-30 -63.2 -38.05 89.65 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.157 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -59.17 -60.94 3.06 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 -62.16 -33.5 74.62 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.117 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.983 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -60.17 -61.48 2.58 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.657 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.455 HD13 ' CD2' ' A' ' 13' ' ' TYR . 54.2 mt -53.44 -43.16 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -61.25 -46.86 88.64 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.206 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.7 m -63.88 -33.7 76.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.61 -44.06 96.74 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.707 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -61.62 -40.72 95.84 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.617 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.66 -37.38 83.84 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.848 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.65 96.6 2.97 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.139 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.69 -16.34 52.34 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.089 1.859 . . . . 0.0 111.395 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.4 m -58.1 -32.63 68.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.822 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -89.12 -3.63 58.58 Favored 'General case' 0 C--O 1.225 -0.184 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.217 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 t -46.96 -39.52 12.55 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.26 -45.13 85.8 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.06 -48.07 66.61 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.285 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.9 mt -58.93 -42.69 90.36 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.234 0.334 . . . . 0.0 110.949 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.18 -48.65 80.85 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.057 0.456 . . . . 0.0 109.816 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.0 -43.4 98.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.7 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -61.08 -36.78 80.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.907 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.64 -44.43 90.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -61.9 -35.27 77.86 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.783 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -60.5 -45.47 93.66 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.097 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.566 HD22 HE22 ' A' ' 26' ' ' GLN . 12.9 mt -65.38 -40.74 93.87 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.025 179.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -60.59 -48.68 80.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.342 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.63 -38.58 90.81 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.397 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.96 -51.44 13.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.43 -27.43 67.83 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.895 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.43 142.97 48.79 Favored Pre-proline 0 N--CA 1.47 0.566 0 CA-C-O 120.846 0.355 . . . . 0.0 111.874 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.92 169.36 7.47 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.44 2.093 . . . . 0.0 112.013 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.645 179.207 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm . . . . . 0 C--O 1.241 0.644 0 CA-C-O 120.945 0.403 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -62.35 -35.27 78.58 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.149 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 58.2 mtt -62.21 -40.65 96.82 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -62.33 -41.83 98.89 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.72 -50.28 71.71 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.035 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.73 -34.93 77.82 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.04 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -55.48 -51.89 65.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.973 0.416 . . . . 0.0 110.802 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -66.04 -45.7 80.47 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.498 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -60.18 -40.7 90.93 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.743 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.68 -55.34 23.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.06 -31.44 65.21 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.458 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -61.71 -37.42 84.09 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.355 0.41 . . . . 0.0 111.153 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -67.58 121.21 78.18 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -87.2 -34.43 0.13 Allowed 'Trans proline' 0 N--CA 1.502 1.981 0 C-N-CA 123.346 2.698 . . . . 0.0 114.817 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -61.84 -20.31 63.53 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.134 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.92 127.35 31.68 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.036 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -50.18 147.13 4.37 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.072 0.857 . . . . 0.0 110.089 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -50.38 -39.83 47.84 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.53 -41.85 71.99 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.473 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.6 HE22 HD22 ' A' ' 51' ' ' LEU . 89.4 mt-30 -61.2 -38.48 86.74 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -54.51 -63.51 1.13 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.923 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -61.52 -33.38 73.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.248 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.82 -59.35 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -61.21 -44.77 96.76 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.63 -42.0 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.098 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 46.5 mmm-85 -77.61 -33.73 53.61 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.504 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.4 p -58.13 -31.82 67.56 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.708 -0.224 . . . . 0.0 110.92 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -41.42 86.06 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.708 0.289 . . . . 0.0 110.395 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -65.35 -44.1 88.75 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.579 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.8 -38.39 81.79 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.556 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.54 88.63 3.95 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.521 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.0 -18.69 64.68 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.292 1.995 . . . . 0.0 111.982 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -60.88 -24.53 66.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.482 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.63 6.65 45.63 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.8 m -41.41 -47.44 3.61 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.84 -44.0 86.84 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -65.56 -44.89 85.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.307 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.8 mt -58.87 -42.55 89.69 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.297 0.373 . . . . 0.0 111.151 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.9 tp -60.82 -47.92 84.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.38 -43.09 99.64 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.669 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -61.75 -37.42 84.21 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.876 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.22 92.22 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -63.03 -36.22 82.85 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.652 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.18 -44.07 92.17 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.6 HD22 HE22 ' A' ' 26' ' ' GLN . 75.9 mt -62.02 -43.06 99.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.956 178.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.07 -47.98 83.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.57 -38.83 88.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.221 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.65 -51.33 17.11 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.161 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -65.95 -27.25 68.02 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.878 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.35 145.74 35.6 Favored Pre-proline 0 N--CA 1.472 0.668 0 O-C-N 123.112 0.257 . . . . 0.0 111.597 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -74.78 153.49 42.97 Favored 'Trans proline' 0 N--CA 1.499 1.826 0 C-N-CA 122.858 2.372 . . . . 0.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.488 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.2 tptp . . . . . 0 N--CA 1.471 0.582 0 N-CA-C 111.507 0.188 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -62.73 -34.11 76.52 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.8 ttm -61.72 -47.2 86.35 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.198 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.44 -37.12 82.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.776 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -59.1 -54.81 42.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.952 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.38 68.44 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 121.205 -0.198 . . . . 0.0 111.161 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -55.44 -63.87 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.812 0.339 . . . . 0.0 111.271 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.79 -36.78 78.7 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.843 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -58.68 -42.76 89.28 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.184 -0.207 . . . . 0.0 110.92 -179.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 84.5 mt -65.95 -46.92 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -30.16 66.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.314 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.01 -36.2 76.7 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.296 0.372 . . . . 0.0 111.581 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.01 120.32 62.97 Favored Pre-proline 0 CA--C 1.543 0.673 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -88.48 -26.28 0.61 Allowed 'Trans proline' 0 N--CA 1.502 2.008 0 C-N-CA 123.717 2.945 . . . . 0.0 116.327 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 p30 -85.36 -1.78 57.37 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.2 mt -70.44 139.25 51.73 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -55.92 140.67 42.06 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.451 0.469 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -45.9 -40.08 9.6 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -70.36 -45.07 66.82 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.238 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.564 HE22 HD22 ' A' ' 51' ' ' LEU . 91.4 mt-30 -60.59 -38.14 83.65 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.129 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -54.93 -55.84 26.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.476 0.179 . . . . 0.0 111.31 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.3 mtt85 -71.1 -33.31 70.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.216 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.75 -57.9 10.91 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -59.74 -46.0 90.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.23 -39.53 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -67.55 -42.22 83.0 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.881 0.372 . . . . 0.0 110.175 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -60.08 -35.15 74.54 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.035 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.41 -51.31 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 123.356 0.41 . . . . 0.0 110.761 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.85 -42.52 97.56 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.973 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.63 -37.76 85.18 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.674 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -142.17 79.31 16.15 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 123.159 0.287 . . . . 0.0 110.965 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -55.35 -25.09 46.06 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.79 2.327 . . . . 0.0 112.534 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -59.92 -31.27 69.67 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.464 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -91.94 4.11 53.72 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.256 0.347 . . . . 0.0 111.405 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.5 p -40.02 -55.28 2.09 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.78 -39.0 92.85 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.123 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -68.4 -49.21 61.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.48 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.27 -41.42 79.68 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.286 0.366 . . . . 0.0 111.15 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -61.86 -49.7 75.2 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.39 96.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.821 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -63.34 -38.3 90.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.585 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.69 -42.47 95.31 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -63.25 -36.13 82.65 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.584 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -59.73 -44.52 93.74 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.147 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.564 HD22 HE22 ' A' ' 26' ' ' GLN . 77.4 mt -62.92 -42.78 99.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.976 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -60.95 -48.23 82.77 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.338 178.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -62.05 -38.59 89.32 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.435 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.92 -51.46 12.4 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -66.32 -27.88 68.25 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.75 150.91 24.77 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.179 0.3 . . . . 0.0 111.601 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.67 153.61 69.15 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 122.927 2.418 . . . . 0.0 112.224 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.8 mptt . . . . . 0 C--O 1.221 -0.404 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.4 -179.866 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 tptm . . . . . 0 C--O 1.241 0.632 0 CA-C-O 120.747 0.308 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -61.11 -33.99 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.538 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.13 -42.94 99.61 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -62.73 -38.88 92.24 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -63.31 -52.77 60.55 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.131 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.42 74.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.037 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -55.97 -56.06 25.27 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.994 0.426 . . . . 0.0 110.988 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -69.97 -43.37 71.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.657 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -58.45 -47.93 82.38 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.277 0.361 . . . . 0.0 111.476 -178.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -63.58 -49.64 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.19 -30.47 66.47 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.523 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -60.52 -36.03 77.39 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.86 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.03 120.4 63.73 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.206 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -87.84 -18.22 2.45 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.606 2.871 . . . . 0.0 115.672 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -87.83 -5.19 58.73 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.2 mt -74.03 132.08 42.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.792 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -54.89 151.5 8.58 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.985 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -54.47 -39.93 67.95 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.78 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -71.65 -45.55 61.65 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.068 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.498 HE22 HD22 ' A' ' 51' ' ' LEU . 94.6 mt-30 -61.26 -45.15 95.69 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.071 -178.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.05 -52.18 66.46 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.174 0.296 . . . . 0.0 111.11 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -66.21 -33.84 76.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.271 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.77 96.73 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.18 -0.463 . . . . 0.0 112.172 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -61.29 -62.07 2.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.8 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.5 mt -56.21 -41.85 71.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 123.119 0.262 . . . . 0.0 111.527 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -62.79 -51.01 68.78 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 120.964 0.411 . . . . 0.0 110.306 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 89.5 p -64.05 -23.9 67.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.245 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -46.51 89.68 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -64.3 -44.47 91.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.371 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -61.41 -38.27 86.48 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.303 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -135.59 81.54 41.6 Favored Pre-proline 0 CA--C 1.549 0.909 0 O-C-N 123.398 0.436 . . . . 0.0 110.347 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -63.18 -17.46 60.25 Favored 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 121.909 1.739 . . . . 0.0 112.461 -179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.7 p -65.2 -26.59 68.2 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.23 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -101.96 4.44 39.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.7 m -45.05 -38.91 5.26 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.31 -45.98 74.9 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.702 0.286 . . . . 0.0 110.346 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.68 -46.06 80.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.7 -41.24 81.3 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.336 0.397 . . . . 0.0 111.014 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.9 tp -61.08 -49.02 79.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.9 99.56 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.821 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -61.37 -39.31 90.17 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.841 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.46 97.42 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -65.3 -35.67 81.72 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.711 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -59.39 -47.35 85.77 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.54 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.498 HD22 HE22 ' A' ' 26' ' ' GLN . 13.1 mt -63.66 -38.16 90.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.19 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -48.67 78.14 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.869 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.21 -38.54 89.55 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.14 -51.25 18.63 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.092 -178.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.29 -26.18 67.2 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.912 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.31 145.9 34.49 Favored Pre-proline 0 N--CA 1.471 0.611 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.16 153.5 46.29 Favored 'Trans proline' 0 N--CA 1.498 1.78 0 C-N-CA 122.926 2.417 . . . . 0.0 112.376 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 89.7 mttt . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.524 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 tptm . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 120.514 0.197 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.99 -40.13 92.32 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.4 mtt -64.4 -38.68 91.87 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.163 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -59.76 -40.0 86.69 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.308 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -64.33 -54.99 24.39 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.53 -34.0 76.82 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.933 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CE2' HD13 ' A' ' 31' ' ' ILE . 35.6 t80 -57.88 -57.55 12.3 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.856 0.36 . . . . 0.0 111.439 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -68.99 -44.95 71.82 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.436 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -59.44 -46.4 88.84 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.606 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.55 -42.85 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.296 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.22 -32.57 70.08 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.084 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.54 -33.76 76.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.719 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -61.99 119.12 45.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 122.958 0.161 . . . . 0.0 111.115 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -89.59 -42.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 123.583 2.855 . . . . 0.0 114.796 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.86 -36.82 75.22 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.6 HD11 ' HA ' ' A' ' 52' ' ' ASN . 8.6 mp -63.62 130.43 44.25 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.326 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -51.12 146.94 5.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.407 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -53.78 -38.07 64.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.652 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.64 -43.04 99.81 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.364 0.415 . . . . 0.0 110.457 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.569 ' NE2' HD13 ' A' ' 51' ' ' LEU . 82.2 mt-30 -65.65 -43.48 89.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.361 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -62.68 -50.93 69.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.578 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -62.06 -40.97 97.59 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.681 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.61 -34.46 77.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.791 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -63.41 -59.07 5.16 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.175 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.534 HD13 ' CE2' ' A' ' 13' ' ' TYR . 63.6 mt -61.74 -32.99 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.704 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.09 -46.36 71.2 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.216 0.532 . . . . 0.0 109.683 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 96.5 p -64.99 -21.93 66.92 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.993 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.461 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -59.62 -48.64 80.86 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.778 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -66.35 -41.8 89.02 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.716 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.76 -36.82 84.29 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.385 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -147.66 78.6 9.86 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.228 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.61 -27.73 85.35 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.544 2.163 . . . . 0.0 112.437 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 m -58.99 -30.34 67.9 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.703 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.8 5.76 44.68 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.5 t -45.51 -38.09 5.97 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.3 0.5 . . . . 0.0 111.777 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.06 -46.52 70.84 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.319 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -66.88 -45.84 76.83 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 34' ' ' LEU . 97.7 mt -57.11 -41.66 79.39 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.546 0.529 . . . . 0.0 110.99 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.72 -49.21 75.97 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.59 81.97 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.839 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -62.5 -32.88 73.87 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.488 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.13 -41.75 90.04 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -61.44 -35.21 76.96 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.891 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.42 -51.31 66.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.03 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.569 HD13 ' NE2' ' A' ' 26' ' ' GLN . 89.1 mt -63.51 -39.46 94.49 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.045 179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.6 ' HA ' HD11 ' A' ' 22' ' ' LEU . 39.9 t30 -56.64 -47.93 78.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.08 -31.88 72.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.389 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -53.12 34.69 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -80.89 -26.24 36.97 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.73 157.17 8.06 Favored Pre-proline 0 N--CA 1.472 0.667 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.94 159.05 4.13 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 123.0 2.467 . . . . 0.0 112.464 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt . . . . . 0 CA--C 1.546 0.819 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.604 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 C--O 1.24 0.599 0 CA-C-O 120.966 0.413 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.87 -35.03 77.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.319 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.9 mtt -62.04 -41.55 98.24 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.246 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -62.33 -42.94 99.79 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.348 0.405 . . . . 0.0 109.926 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -61.92 -50.3 72.71 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.35 -31.77 71.4 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.017 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -56.19 -56.62 18.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.819 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.73 -41.28 79.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.069 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -58.67 -42.88 89.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 121.176 -0.209 . . . . 0.0 111.451 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.32 -52.2 55.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.98 68.1 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.402 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.2 tp -60.59 -36.48 78.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.598 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.12 119.67 71.6 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -88.18 -24.22 1.02 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 123.651 2.901 . . . . 0.0 115.69 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.6 -6.3 58.09 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.6 mt -71.7 132.2 44.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.941 -0.703 . . . . 0.0 109.202 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -51.73 151.96 3.11 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.712 0.633 . . . . 0.0 110.926 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -50.95 -40.79 58.26 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -74.93 -48.04 26.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.849 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.42 HE22 HD22 ' A' ' 51' ' ' LEU . 95.6 mt-30 -59.73 -45.7 91.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.226 -178.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 ttmm -56.59 -47.36 79.74 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.287 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -79.54 -32.13 42.14 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.873 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -45.56 91.54 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -59.24 -58.63 7.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.544 -0.462 . . . . 0.0 112.054 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -54.94 -46.05 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 O-C-N 123.094 0.246 . . . . 0.0 111.557 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -62.88 -47.24 84.16 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.767 0.318 . . . . 0.0 110.547 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -61.22 -30.61 70.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.002 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -44.89 92.58 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.07 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.24 -39.53 94.14 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.575 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -67.14 -38.45 85.57 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.706 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -140.06 74.82 30.35 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.225 0.328 . . . . 0.0 110.454 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.87 -16.41 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 112.428 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.2 m -61.48 -29.71 70.14 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.15 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -105.06 9.71 34.27 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.8 m -44.29 -35.08 2.16 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.21 69.39 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.204 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -37.03 72.66 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.24 -178.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.08 -44.46 96.63 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.64 -48.43 81.81 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.74 91.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.846 178.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -63.72 -37.24 86.61 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.806 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.31 93.81 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -63.5 -35.65 81.17 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.943 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -59.13 -47.99 83.26 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.571 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.42 HD22 HE22 ' A' ' 26' ' ' GLN . 12.2 mt -63.32 -38.84 92.72 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.174 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.52 -48.26 80.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.885 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.46 -38.48 89.99 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.086 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.28 -51.26 15.8 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -65.37 -26.84 68.19 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.37 157.31 4.97 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.15 0.281 . . . . 0.0 111.672 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.2 156.51 5.27 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 123.101 2.534 . . . . 0.0 112.954 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.883 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt . . . . . 0 C--O 1.24 0.574 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -61.1 -39.26 89.27 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.498 ' SD ' ' CD2' ' A' ' 34' ' ' LEU . 1.6 mmm -62.8 -43.27 99.23 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.932 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -60.18 -40.11 88.84 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.293 0.37 . . . . 0.0 110.571 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -59.64 -55.85 29.26 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.305 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.68 -29.99 66.44 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -57.24 -59.67 4.76 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.867 0.365 . . . . 0.0 111.179 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -67.85 -42.55 81.22 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.121 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.25 -46.44 89.79 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.129 0.268 . . . . 0.0 111.52 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.48 -47.44 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.274 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.4 -29.38 66.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.533 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -59.88 -36.73 77.54 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 123.264 0.352 . . . . 0.0 111.471 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 120.98 69.4 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -86.88 -34.44 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.258 2.639 . . . . 0.0 114.652 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -19.29 65.43 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 13.1 mt -64.0 132.1 49.6 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.938 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' H ' HE22 ' A' ' 55' ' ' GLN . 23.7 t-20 -55.58 143.18 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -50.23 -39.14 43.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -67.03 -43.95 81.48 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.86 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.466 HE22 HD22 ' A' ' 51' ' ' LEU . 89.1 mt-30 -62.5 -36.96 84.17 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.883 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -59.31 -62.94 1.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 110.694 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.29 -34.94 74.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.15 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.15 -48.45 81.56 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.412 0.445 . . . . 0.0 111.986 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.56 -61.43 2.59 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.253 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.46 HD13 ' CD2' ' A' ' 13' ' ' TYR . 51.4 mt -54.51 -39.42 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 O-C-N 123.336 0.397 . . . . 0.0 111.963 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.84 -50.49 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.7 m -63.53 -34.93 78.87 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.829 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.498 ' CD2' ' SD ' ' A' ' 9' ' ' MET . 3.9 tt -59.11 -42.22 90.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.955 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -63.11 -45.42 92.09 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.53 -36.76 85.25 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.452 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -139.14 82.0 20.21 Favored Pre-proline 0 CA--C 1.545 0.761 0 O-C-N 123.334 0.396 . . . . 0.0 111.521 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.7 -17.38 49.26 Favored 'Trans proline' 0 N--CA 1.505 2.149 0 C-N-CA 122.499 2.132 . . . . 0.0 111.993 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.7 m -57.26 -33.78 67.96 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.288 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -91.62 -0.59 57.59 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 123.187 0.304 . . . . 0.0 111.521 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.6 t -46.11 -37.78 7.28 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 117.694 0.224 . . . . 0.0 111.579 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -45.51 70.5 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -66.82 -47.27 72.53 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.051 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.52 -40.45 82.93 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.305 0.378 . . . . 0.0 110.752 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 15.4 tp -61.02 -49.04 79.01 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.703 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -61.44 -38.16 86.15 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.655 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.1 96.43 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 tttt -64.52 -37.57 88.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.161 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -60.65 -44.3 96.59 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.794 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.466 HD22 HE22 ' A' ' 26' ' ' GLN . 78.1 mt -62.45 -44.57 96.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.508 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.5 -48.14 82.79 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.401 179.12 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.25 -37.95 84.95 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.036 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.01 17.42 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.954 -178.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.444 HE22 ' H ' ' A' ' 23' ' ' ASN . 52.5 mt-30 -65.34 -27.25 68.46 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.894 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -52.92 151.76 8.11 Favored Pre-proline 0 N--CA 1.475 0.777 0 O-C-N 123.213 0.321 . . . . 0.0 111.835 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.4 170.41 4.22 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.742 2.294 . . . . 0.0 112.152 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.7 mttt . . . . . 0 N--CA 1.477 0.913 0 O-C-N 124.285 0.991 . . . . 0.0 110.778 179.96 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 mptt . . . . . 0 C--O 1.238 0.488 0 CA-C-O 120.73 0.3 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -61.25 -34.13 74.65 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.67 -42.92 99.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.432 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.44 -38.74 92.3 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -63.59 -53.89 44.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.766 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -31.83 72.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.057 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -56.72 -56.11 25.56 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.02 0.438 . . . . 0.0 110.594 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -68.38 -44.58 74.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.588 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.35 -42.05 94.9 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.0 mt -65.01 -49.78 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.37 -25.13 61.69 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.17 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.02 -37.68 74.77 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.356 0.41 . . . . 0.0 111.98 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.9 mm? -69.93 119.9 74.44 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -89.01 -20.73 1.39 Allowed 'Trans proline' 0 N--CA 1.5 1.899 0 C-N-CA 123.208 2.605 . . . . 0.0 115.134 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 p30 -86.97 -2.57 58.72 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.403 HD23 ' OE1' ' A' ' 55' ' ' GLN . 39.8 mt -71.36 135.13 47.16 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.387 178.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -51.33 143.64 11.13 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.586 0.554 . . . . 0.0 110.095 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -47.97 -39.96 20.99 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.403 0.439 . . . . 0.0 112.152 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.65 -44.4 74.19 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.023 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.561 HE22 HD22 ' A' ' 51' ' ' LEU . 91.5 mt-30 -62.68 -36.95 84.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.111 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -57.55 -56.78 17.43 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.666 0.269 . . . . 0.0 110.973 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -68.71 -34.53 75.8 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.182 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.61 -52.41 63.89 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -59.45 -61.25 2.76 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 120.422 -0.511 . . . . 0.0 112.118 -178.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.7 -41.67 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.188 0.305 . . . . 0.0 111.657 -178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.0 ttt-85 -63.28 -49.28 74.68 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.924 0.392 . . . . 0.0 110.175 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 57.1 m -61.19 -30.22 70.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.024 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.14 -43.86 92.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.061 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -66.17 -41.95 89.6 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.011 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -43.11 88.41 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.876 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -135.94 74.51 57.03 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.018 0.437 . . . . 0.0 110.638 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -60.68 -11.03 15.75 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.486 2.124 . . . . 0.0 113.11 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.4 p -62.02 -25.08 67.45 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.83 16.81 19.4 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -48.56 -37.24 17.32 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.86 -45.23 90.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.425 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -64.3 -47.17 80.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.113 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.81 -41.86 78.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.408 0.443 . . . . 0.0 111.267 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.56 -49.99 75.34 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.03 99.74 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.764 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -59.92 -38.08 81.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.864 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -47.76 81.01 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -62.53 -37.78 87.43 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.336 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -60.2 -45.29 93.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.272 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.561 HD22 HE22 ' A' ' 26' ' ' GLN . 9.3 mt -64.87 -39.8 94.13 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -60.02 -49.1 79.0 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.429 0.456 . . . . 0.0 110.307 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.63 -38.87 89.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.265 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.51 -51.37 14.93 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.403 ' OE1' HD23 ' A' ' 22' ' ' LEU . 68.5 mt-30 -65.45 -27.94 68.87 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.614 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.34 145.0 59.96 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.288 0.367 . . . . 0.0 111.467 -179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.47 151.62 47.92 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.923 2.415 . . . . 0.0 112.261 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt . . . . . 0 C--O 1.223 -0.329 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.408 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.569 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -40.84 97.36 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.507 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -58.49 -41.29 84.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.457 0.473 . . . . 0.0 110.806 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -63.22 -54.97 29.07 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.146 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.55 78.24 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.291 -179.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -55.89 -53.01 61.94 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.904 0.383 . . . . 0.0 111.153 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.4 t90 -67.54 -46.38 72.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.219 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.41 -43.5 96.65 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.846 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 93.2 mt -64.74 -48.96 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -31.34 68.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.304 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.51 -35.96 77.2 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.295 0.372 . . . . 0.0 111.531 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -67.67 120.24 71.95 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -88.62 -26.92 0.49 Allowed 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 123.663 2.908 . . . . 0.0 116.297 -178.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -83.71 -0.66 51.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -176.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.0 mt -72.28 135.21 45.92 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.319 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -54.11 142.84 24.15 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.654 0.596 . . . . 0.0 110.234 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -47.6 -42.63 24.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -66.61 -41.47 88.34 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.287 0.367 . . . . 0.0 111.383 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.65 HE22 HD22 ' A' ' 51' ' ' LEU . 90.4 mt-30 -64.98 -41.36 95.51 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.063 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -52.99 -54.38 35.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.717 0.294 . . . . 0.0 111.172 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -71.43 -36.05 71.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.401 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.83 -55.37 36.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -60.25 -54.13 49.4 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.9 mt -58.22 -41.1 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.188 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -64.81 -48.03 75.88 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.04 0.447 . . . . 0.0 109.999 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.2 t -61.81 -24.99 67.22 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.361 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.14 -43.94 98.11 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.649 0.593 . . . . 0.0 109.52 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -67.18 -39.9 86.5 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -64.6 -30.63 71.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.339 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -144.74 76.62 13.96 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 120.771 0.319 . . . . 0.0 110.683 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -54.42 -31.41 68.27 Favored 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.987 2.458 . . . . 0.0 112.698 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -59.36 -28.45 66.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.203 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -92.74 1.88 57.04 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.2 t -44.02 -41.66 5.57 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.69 -46.0 76.99 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.667 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -67.18 -46.11 74.95 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.181 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -57.73 -43.45 85.34 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.159 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.7 tp -60.92 -49.87 75.72 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.38 97.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.804 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -62.57 -39.02 92.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.348 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -40.95 97.13 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -63.81 -36.38 83.71 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.586 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -59.81 -44.31 94.05 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.15 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.65 HD22 HE22 ' A' ' 26' ' ' GLN . 80.7 mt -62.54 -43.09 99.67 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.1 178.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.24 -48.38 81.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.29 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -61.76 -38.42 87.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.494 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.47 -51.55 11.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.8 -27.92 68.63 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 146.04 56.64 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.166 0.291 . . . . 0.0 111.485 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.82 153.76 58.77 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.997 2.465 . . . . 0.0 112.22 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mttp . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.484 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.2 mttt . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.98 -43.19 99.47 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.362 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.667 ' SD ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -63.17 -44.72 94.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.967 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -57.68 -41.43 81.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.318 0.387 . . . . 0.0 111.05 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -61.01 -57.14 13.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.465 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -30.33 68.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.456 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CD2' HD13 ' A' ' 31' ' ' ILE . 42.0 t80 -56.37 -58.99 5.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.895 0.379 . . . . 0.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -65.74 -43.26 89.49 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.652 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -59.91 -50.75 72.56 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.186 0.303 . . . . 0.0 111.27 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 89.7 mt -63.57 -47.08 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 120.575 0.226 . . . . 0.0 110.484 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.41 -29.42 64.11 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.64 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -60.65 -36.98 80.04 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.241 0.338 . . . . 0.0 111.641 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.32 120.02 61.31 Favored Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -88.85 -26.18 0.55 Allowed 'Trans proline' 0 N--CA 1.503 2.038 0 C-N-CA 123.696 2.931 . . . . 0.0 116.28 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -84.62 -0.44 53.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.6 mt -72.84 135.65 45.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.579 178.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -53.89 143.52 21.15 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.698 0.624 . . . . 0.0 110.136 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -47.85 -40.74 22.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -68.8 -43.13 76.26 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.684 0.278 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.605 HE22 HD22 ' A' ' 51' ' ' LEU . 95.1 mt-30 -63.81 -37.73 88.48 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.273 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -56.36 -55.07 38.03 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.733 0.302 . . . . 0.0 111.279 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm180 -72.21 -31.9 66.27 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.494 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.1 -50.34 73.1 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.4 -55.41 31.8 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 13' ' ' TYR . 49.2 mt -56.79 -38.34 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 122.966 0.166 . . . . 0.0 111.31 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 mmm-85 -65.94 -42.29 90.24 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.5 t -61.89 -30.58 70.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.084 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.667 HD12 ' SD ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -53.51 -51.07 63.99 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.781 179.577 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.27 -39.51 94.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -56.98 -38.08 72.52 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.599 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.92 104.62 1.15 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 121.165 -0.214 . . . . 0.0 111.19 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.18 -17.39 59.54 Favored 'Trans proline' 0 N--CA 1.502 1.971 0 C-N-CA 121.898 1.732 . . . . 0.0 111.69 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.3 p -59.52 -30.71 68.77 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -96.39 1.14 51.49 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.124 0.265 . . . . 0.0 111.461 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.3 p -43.7 -51.82 6.88 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.54 91.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.744 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -69.11 -49.06 60.5 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.295 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.2 mt -56.72 -45.09 82.09 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.495 0.497 . . . . 0.0 110.923 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.99 -52.21 66.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.27 86.68 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.056 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -62.54 -37.72 87.22 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.261 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.64 95.65 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -63.54 -35.47 80.58 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.783 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -59.64 -47.14 86.77 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.342 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.605 HD22 HE22 ' A' ' 26' ' ' GLN . 13.9 mt -63.36 -39.74 95.36 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.335 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.3 -48.43 81.43 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.316 0.385 . . . . 0.0 110.114 178.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -62.4 -38.68 90.6 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.312 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.34 -51.56 12.88 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -66.35 -27.93 68.27 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.23 146.44 61.97 Favored Pre-proline 0 CA--C 1.537 0.466 0 O-C-N 123.206 0.316 . . . . 0.0 111.327 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.18 158.8 55.16 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.846 2.364 . . . . 0.0 111.989 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt . . . . . 0 CA--C 1.541 0.609 0 O-C-N 124.059 0.85 . . . . 0.0 110.923 -179.975 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 120.498 0.19 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.28 -44.22 97.59 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.361 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -38.73 92.22 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -59.21 -39.22 81.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.63 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -65.26 -55.24 19.54 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.057 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.8 -34.96 79.07 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.949 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -56.57 -52.95 62.88 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.214 0.531 . . . . 0.0 110.625 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -62.53 -46.01 90.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.775 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -61.09 -42.31 98.27 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -178.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.3 mt -62.34 -53.86 41.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 120.638 0.256 . . . . 0.0 110.421 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.83 -30.58 67.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.37 -37.14 79.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 123.242 0.339 . . . . 0.0 111.203 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.65 120.8 68.92 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.14 -21.6 1.57 Allowed 'Trans proline' 0 N--CA 1.504 2.134 0 C-N-CA 123.824 3.016 . . . . 0.0 116.236 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -89.85 -0.15 57.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -176.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.8 mt -74.89 138.37 42.39 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.85 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -60.94 145.93 48.65 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.834 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -51.38 -42.38 61.35 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.06 -37.95 81.86 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.221 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.441 HE22 HD22 ' A' ' 51' ' ' LEU . 92.3 mt-30 -67.32 -53.96 24.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 28' ' ' ARG . 1.5 ptpm? -56.34 -48.58 76.49 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.68 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.419 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 77.9 mtt85 -63.25 -33.44 75.51 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.763 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.66 -55.64 16.42 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -60.0 -41.2 91.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.146 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 mm -57.05 -42.3 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -72.55 -35.69 68.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.194 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -57.51 -33.66 68.29 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.508 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 34' ' ' LEU . 2.8 mm? -51.72 -53.6 37.58 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.168 0.292 . . . . 0.0 110.368 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.16 -39.69 95.39 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.051 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.26 -40.86 95.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.503 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -151.31 82.92 5.63 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 123.243 0.339 . . . . 0.0 110.332 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.76 -24.97 80.18 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.411 2.074 . . . . 0.0 112.13 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -59.6 -33.15 71.1 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.172 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -88.76 8.69 27.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.439 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.3 p -43.35 -48.74 6.97 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.94 95.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.696 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.35 -47.26 61.84 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.294 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -58.14 -43.97 87.6 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.314 0.384 . . . . 0.0 110.857 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.78 -49.08 78.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.14 -41.92 97.6 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.881 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -62.89 -37.69 87.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.824 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.27 90.75 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -63.17 -36.31 83.21 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.624 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -58.54 -43.7 89.36 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.352 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.441 HD22 HE22 ' A' ' 26' ' ' GLN . 75.6 mt -63.11 -41.98 99.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.988 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.68 -47.81 82.05 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.326 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -61.76 -37.86 85.85 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.348 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.78 -50.69 14.49 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -67.88 -27.46 66.68 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 158.48 5.58 Favored Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.19 155.8 11.36 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.151 2.567 . . . . 0.0 112.993 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.3 mptt . . . . . 0 CA--C 1.534 0.357 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.414 -179.871 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -61.97 -41.82 98.44 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.742 -179.6 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.411 ' SD ' ' HB3' ' A' ' 38' ' ' PRO . 73.7 mtm -64.26 -37.05 86.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.878 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -61.04 -39.8 91.19 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.852 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -61.75 -43.47 98.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.953 179.163 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.05 -40.13 87.05 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.259 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -48.93 76.94 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.566 179.908 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -61.37 -44.41 97.21 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -61.36 -39.93 92.45 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 82.0 mt -60.97 -52.77 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.279 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.31 -31.42 67.49 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.424 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.99 -35.76 77.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.573 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -70.26 121.71 84.05 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.495 -179.282 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -87.34 -22.81 1.59 Allowed 'Trans proline' 0 N--CA 1.507 2.268 0 C-N-CA 123.823 3.015 . . . . 0.0 115.259 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.95 79.98 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -177.645 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.692 HD12 ' H ' ' A' ' 22' ' ' LEU . 4.1 mp -73.01 132.31 43.23 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.977 0.417 . . . . 0.0 111.025 -178.714 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.36 156.98 3.97 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.101 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -57.07 -42.13 80.04 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.305 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -43.92 96.1 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.859 -179.391 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -62.99 -39.06 93.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.71 179.85 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -58.4 -64.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.935 -179.384 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -59.58 -34.22 72.44 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.721 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.24 -43.77 95.79 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.281 0.363 . . . . 0.0 111.53 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -63.54 -52.52 60.77 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.93 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.0 mm -56.41 -46.03 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.155 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -61.49 -47.79 84.03 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 120.679 0.276 . . . . 0.0 110.358 179.737 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.8 t -62.34 -30.46 71.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.246 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.18 -51.47 69.6 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.449 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -62.28 -40.52 96.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.678 179.086 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.77 -40.05 93.81 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.116 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -136.76 82.89 31.01 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.668 -179.357 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.411 ' HB3' ' SD ' ' A' ' 9' ' ' MET . 51.7 Cg_exo -53.49 -28.23 44.01 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.869 2.379 . . . . 0.0 112.424 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.5 -35.01 73.32 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.008 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -82.66 -1.47 51.21 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.091 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.0 p -41.31 -54.43 3.0 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.001 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.74 92.35 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -67.95 -50.22 57.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.745 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -57.05 -40.76 77.43 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 123.091 0.244 . . . . 0.0 111.15 -178.89 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.4 tp -61.49 -50.3 73.29 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.732 179.164 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.18 89.83 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.824 178.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -62.19 -36.5 82.1 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.58 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.58 -39.66 91.85 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -63.68 -39.65 94.84 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.609 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.83 -51.89 66.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.37 -36.3 83.57 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.458 ' HB2' HD11 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.96 -49.11 78.79 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.371 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -63.68 -37.03 85.79 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.729 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.7 -52.25 13.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -177.959 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -68.31 -25.88 65.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.52 149.45 39.79 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 123.06 0.225 . . . . 0.0 111.085 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.93 155.01 62.85 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 122.776 2.318 . . . . 0.0 112.272 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? . . . . . 0 N--CA 1.476 0.83 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.865 179.921 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -57.96 -46.49 85.01 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 120.803 0.335 . . . . 0.0 111.115 -178.718 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -50.3 72.32 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.48 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -55.78 -41.55 74.22 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 123.569 0.543 . . . . 0.0 111.61 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -58.42 -61.89 2.25 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.501 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.29 -23.52 64.76 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.294 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -58.71 -58.93 6.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' TRP . . . . . 0.449 ' CD1' ' C ' ' A' ' 14' ' ' TRP . 0.4 OUTLIER -73.58 -35.45 65.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.515 -178.937 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.68 -47.46 85.55 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.198 0.311 . . . . 0.0 110.793 -179.286 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.427 HG23 ' HB1' ' A' ' 48' ' ' ALA . 96.7 mt -68.58 -49.92 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.832 179.451 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.0 -24.94 42.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.773 -178.931 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.1 tp -56.7 -39.03 73.12 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.359 0.412 . . . . 0.0 111.899 -179.044 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.477 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.1 mm? -68.73 120.89 78.83 Favored Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -89.19 -9.94 4.18 Favored 'Trans proline' 0 N--CA 1.504 2.119 0 C-N-CA 123.597 2.865 . . . . 0.0 115.671 -178.222 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.4 p30 -95.84 -1.43 49.53 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.439 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -75.25 130.36 38.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.69 178.759 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.89 148.12 10.96 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.628 0.58 . . . . 0.0 109.612 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -53.05 -44.0 67.07 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.47 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -65.54 -42.17 92.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.177 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.564 HE22 HD22 ' A' ' 51' ' ' LEU . 91.8 mt-30 -65.22 -48.2 74.18 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.303 -179.428 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -61.34 -49.13 78.2 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 123.303 0.377 . . . . 0.0 110.688 -179.631 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.74 -39.51 91.84 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.641 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.03 -44.44 95.92 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.156 -179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -60.31 -56.93 15.53 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.649 -179.145 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.1 mt -57.89 -44.19 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 123.162 0.289 . . . . 0.0 110.978 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.7 ttt-85 -62.17 -50.02 73.5 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.843 0.354 . . . . 0.0 110.616 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 t -58.15 -29.31 65.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -45.61 91.46 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -64.12 -39.74 94.68 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.368 178.686 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -59.81 -36.29 76.47 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.05 92.68 2.58 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.82 -179.843 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.98 -18.68 51.63 Favored 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.381 2.054 . . . . 0.0 111.901 179.103 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.1 p -59.43 -25.32 64.24 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.811 -179.459 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -102.26 0.87 35.07 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.956 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.3 m -46.1 -39.74 9.86 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.673 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.78 84.1 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -67.3 -48.05 68.78 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.28 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.1 mt -57.46 -43.01 83.65 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.233 0.333 . . . . 0.0 111.056 -179.155 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.0 -50.96 71.69 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.26 0.553 . . . . 0.0 109.687 179.083 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.0 -41.33 96.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.04 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -63.72 -38.12 89.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.776 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.427 ' HB1' HG23 ' A' ' 16' ' ' ILE . . . -63.62 -44.69 93.19 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -63.49 -32.96 74.55 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.05 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -60.27 -47.47 85.85 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.953 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.564 HD22 HE22 ' A' ' 26' ' ' GLN . 7.8 mt -63.82 -37.11 86.15 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.004 178.914 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.66 -48.77 77.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.988 178.928 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.52 -38.75 91.18 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.88 -51.58 15.74 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.161 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.5 -27.5 67.83 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.067 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.48 145.44 48.74 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 123.237 0.335 . . . . 0.0 111.588 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.28 154.71 41.41 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 123.084 2.523 . . . . 0.0 112.476 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.392 179.805 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -62.95 -40.03 96.42 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.669 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -39.36 93.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.555 179.308 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -59.28 -43.59 92.51 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 123.378 0.424 . . . . 0.0 110.649 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -62.75 -50.83 69.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.268 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.05 78.34 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.139 -179.603 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -55.8 -55.82 27.87 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.969 0.414 . . . . 0.0 110.895 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -64.98 -45.66 84.73 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.442 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -58.61 -49.48 77.32 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.511 -178.515 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 85.6 mt -57.76 -50.17 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.662 0.268 . . . . 0.0 110.877 179.621 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.57 -25.42 64.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.935 -179.719 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -60.81 -38.28 84.86 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.238 0.336 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.51 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.4 mm? -66.58 121.11 75.72 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.016 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.75 -8.05 5.25 Favored 'Trans proline' 0 N--CA 1.503 2.031 0 C-N-CA 123.592 2.862 . . . . 0.0 115.587 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -98.97 -2.3 37.73 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.929 0.714 . . . . 0.0 112.929 -177.499 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.98 130.9 39.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.451 178.836 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -52.28 145.61 10.65 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.199 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -50.79 -41.0 56.74 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.806 -178.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.59 -42.11 83.03 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.926 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.66 HE22 HD22 ' A' ' 51' ' ' LEU . 90.2 mt-30 -62.31 -42.18 99.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.697 -179.053 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm -55.42 -63.8 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.632 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -58.21 -32.24 68.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.247 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.77 -62.31 1.89 Allowed 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.174 0.297 . . . . 0.0 111.209 -179.068 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -61.55 -40.29 94.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.086 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.4 -39.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.291 179.025 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -75.1 -39.31 60.79 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.571 178.797 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.3 m -55.0 -35.45 64.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.544 -179.258 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.33 -43.98 71.7 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.248 0.342 . . . . 0.0 110.527 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -68.43 -41.01 80.97 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.173 178.939 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.22 -41.89 94.03 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.098 -178.951 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.17 85.21 6.98 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 120.862 0.363 . . . . 0.0 111.098 -179.349 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -54.83 -23.73 35.23 Favored 'Trans proline' 0 N--CA 1.502 1.988 0 C-N-CA 122.908 2.405 . . . . 0.0 112.755 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.7 p -61.91 -27.76 69.04 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.809 -179.284 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -96.13 8.01 44.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -178.666 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m -44.78 -40.87 6.45 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -178.789 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -45.39 75.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.788 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -67.52 -48.29 67.47 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.705 -179.178 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -57.33 -45.53 84.17 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.225 0.328 . . . . 0.0 111.291 -178.75 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.2 tp -60.1 -49.34 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.34 -40.5 94.49 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.817 178.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -64.17 -38.98 92.99 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 179.33 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.55 -46.55 82.32 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.558 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -63.27 -32.2 73.54 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.046 179.306 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.2 -44.44 95.11 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.897 179.112 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.66 HD22 HE22 ' A' ' 26' ' ' GLN . 45.7 mt -63.21 -39.42 94.57 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.906 178.607 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -62.98 -49.14 75.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.247 178.758 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.42 -38.61 90.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.256 -179.58 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.52 -51.62 14.19 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.031 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -66.2 -27.34 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.132 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 145.33 60.13 Favored Pre-proline 0 CA--C 1.539 0.524 0 O-C-N 123.227 0.329 . . . . 0.0 111.266 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -74.74 153.45 43.14 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 122.895 2.396 . . . . 0.0 112.42 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.44 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.6 t . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.54 -67.86 0.42 Allowed 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.43 -61.48 1.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.383 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -176.93 152.4 0.93 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.178 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -79.35 56.21 2.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.437 0.637 . . . . 0.0 111.753 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -66.11 -29.02 69.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.487 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -56.5 -38.38 71.69 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.305 -0.407 . . . . 0.0 112.091 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -61.68 -40.01 93.44 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.406 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 12.6 mtt -66.0 -39.56 90.38 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.753 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -58.01 -45.1 87.44 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.502 0.501 . . . . 0.0 110.742 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.43 -51.31 68.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.91 68.26 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.109 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.98 -64.89 0.78 Allowed 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.796 0.331 . . . . 0.0 110.769 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -71.06 -36.23 72.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.91 -40.73 81.09 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.995 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.67 -44.73 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.89 64.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.157 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.15 -37.63 80.69 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.938 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.505 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.5 mm? -66.02 120.87 72.86 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 120.32 -0.552 . . . . 0.0 109.877 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.37 -7.89 5.66 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.665 2.91 . . . . 0.0 115.78 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -99.18 -2.17 37.46 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.4 mt -74.51 133.26 42.32 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.314 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -53.09 146.8 10.68 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.067 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -51.96 -40.7 61.28 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -68.24 -42.51 79.61 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.95 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.493 HE22 HD22 ' A' ' 51' ' ' LEU . 90.7 mt-30 -64.17 -43.37 95.35 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.716 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -57.15 -48.0 79.77 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.54 0.21 . . . . 0.0 111.16 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.31 -35.85 68.74 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.62 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.14 -56.77 17.91 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -59.95 -45.81 91.43 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.796 -0.361 . . . . 0.0 111.947 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.8 mt -58.6 -38.66 72.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.664 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -74.24 -32.53 63.01 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -58.23 -33.22 69.11 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.842 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -52.64 -50.27 63.5 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -63.27 -39.19 93.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.112 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.28 -38.28 79.77 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.701 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.46 84.53 2.55 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 120.859 0.361 . . . . 0.0 110.728 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.07 -25.22 44.1 Favored 'Trans proline' 0 N--CA 1.502 1.976 0 C-N-CA 122.834 2.356 . . . . 0.0 112.631 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.6 p -60.41 -30.91 69.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.556 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -92.08 8.83 36.0 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.171 0.295 . . . . 0.0 111.767 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.0 p -43.65 -50.86 7.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.45 92.95 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.322 0.389 . . . . 0.0 110.895 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -70.37 -49.62 47.31 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -57.0 -44.82 83.17 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.319 0.387 . . . . 0.0 111.054 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.9 tp -60.2 -48.64 80.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.96 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.81 -43.37 98.99 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -61.22 -38.89 88.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.939 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.92 88.4 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -63.1 -32.42 73.79 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.943 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -60.77 -43.66 97.75 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.84 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD22 HE22 ' A' ' 26' ' ' GLN . 58.4 mt -62.82 -39.67 95.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.802 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.42 -49.83 72.21 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.093 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.56 -38.57 90.57 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.21 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -51.55 15.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -65.83 -27.27 68.12 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.28 145.33 57.74 Favored Pre-proline 0 CA--C 1.54 0.558 0 O-C-N 123.144 0.278 . . . . 0.0 111.277 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.39 170.03 5.83 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.515 2.144 . . . . 0.0 111.805 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 CA--C 1.547 0.864 0 CA-C-O 117.565 -1.207 . . . . 0.0 110.606 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 1' ' ' VAL . 8.7 p . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.37 -65.89 0.76 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.929 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -90.38 -61.22 1.73 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.207 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 mmtp -178.05 155.35 0.95 Allowed 'General case' 0 N--CA 1.471 0.611 0 O-C-N 123.333 0.396 . . . . 0.0 110.4 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -90.37 47.16 1.4 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.483 0.659 . . . . 0.0 110.522 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.37 -26.45 30.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.565 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -55.98 -35.64 66.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.359 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.91 -40.52 96.67 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 121.09 -0.244 . . . . 0.0 110.655 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtm -62.14 -46.14 90.31 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.284 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -58.11 -39.72 79.35 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.507 0.505 . . . . 0.0 110.986 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -60.53 -57.56 12.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.153 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.35 68.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 31' ' ' ILE . 40.1 t80 -55.24 -58.77 6.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.202 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -71.09 -38.77 72.39 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -60.18 -43.13 96.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.962 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 87.7 mt -65.19 -47.53 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -30.85 68.2 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -59.51 -35.95 75.13 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.531 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mp -67.06 120.34 71.24 Favored Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -88.38 -26.23 0.64 Allowed 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.752 2.968 . . . . 0.0 116.247 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -84.66 -0.22 52.68 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.5 132.91 43.42 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.525 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -50.62 145.49 6.68 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.815 0.697 . . . . 0.0 109.781 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -50.49 -40.3 50.69 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -67.36 -41.43 85.11 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.686 0.279 . . . . 0.0 111.004 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.623 HE22 HD22 ' A' ' 51' ' ' LEU . 90.0 mt-30 -65.23 -39.56 92.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.933 -179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -55.3 -53.75 52.21 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.646 0.26 . . . . 0.0 111.459 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -72.69 -34.03 66.9 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.432 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.68 -59.62 5.09 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -59.0 -47.04 86.62 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.413 HG23 ' CD2' ' A' ' 13' ' ' TYR . 57.1 mt -59.78 -37.32 70.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.214 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -69.72 -37.89 76.71 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.7 m -58.94 -32.86 69.98 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.613 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 34' ' ' LEU . 1.9 mm? -51.22 -56.59 12.08 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 120.788 0.328 . . . . 0.0 110.299 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -62.68 -38.62 91.08 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.179 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.96 -36.54 72.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.993 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -161.98 82.9 1.75 Allowed Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 120.647 0.261 . . . . 0.0 111.106 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -56.81 -19.16 30.1 Favored 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.81 2.34 . . . . 0.0 112.919 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 t -57.42 -34.5 68.99 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.095 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -104.86 18.08 22.97 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.105 0.253 . . . . 0.0 111.071 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.8 p -50.82 -39.01 52.13 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -38.98 92.8 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.1 0.476 . . . . 0.0 109.934 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -68.59 -46.31 69.7 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.135 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.9 mt -57.35 -45.71 84.07 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.352 0.408 . . . . 0.0 111.289 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 tp -60.49 -49.38 77.8 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.58 95.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.823 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -64.05 -39.59 94.42 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.654 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.05 95.42 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -64.85 -37.46 87.69 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.398 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -59.6 -43.25 93.77 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.219 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.623 HD22 HE22 ' A' ' 26' ' ' GLN . 82.1 mt -63.18 -43.06 99.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.949 179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -61.51 -48.24 81.96 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.261 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.35 -38.4 86.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.506 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.53 -51.52 11.54 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -66.3 -27.86 68.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.93 144.81 56.41 Favored Pre-proline 0 CA--C 1.539 0.529 0 O-C-N 123.157 0.286 . . . . 0.0 111.593 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.31 153.58 50.84 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 122.982 2.454 . . . . 0.0 112.326 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.418 179.817 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -78.27 0.06 Allowed 'General case' 0 CA--C 1.534 0.338 0 O-C-N 123.31 0.381 . . . . 0.0 110.479 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -90.28 -61.01 1.77 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.062 0.226 . . . . 0.0 110.849 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -169.37 149.6 4.09 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.103 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -82.36 51.24 1.78 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.458 0.647 . . . . 0.0 111.777 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -62.2 -33.55 74.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.198 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -54.95 -49.51 71.18 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.34 0.4 . . . . 0.0 111.802 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.66 -34.34 72.7 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.1 0.476 . . . . 0.0 109.989 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -43.64 97.14 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.949 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.98 -39.23 88.83 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.979 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -61.46 -55.94 25.63 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.846 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.65 74.26 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -55.69 -59.72 4.45 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.622 0.248 . . . . 0.0 111.34 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -71.08 -38.09 72.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.166 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.23 -41.65 89.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.802 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.76 -48.97 80.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.73 -30.6 67.6 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.0 tp -60.33 -36.27 77.56 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.663 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -64.42 120.69 67.35 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -87.83 -27.72 0.52 Allowed 'Trans proline' 0 N--CA 1.504 2.107 0 C-N-CA 123.765 2.977 . . . . 0.0 116.271 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -83.89 -0.5 51.55 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.2 mt -72.94 135.98 45.11 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.373 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -55.11 144.94 22.25 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.537 0.523 . . . . 0.0 109.973 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -49.66 -41.51 43.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -66.16 -41.42 90.37 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.149 0.281 . . . . 0.0 110.912 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.692 HE22 HD22 ' A' ' 51' ' ' LEU . 90.5 mt-30 -65.44 -40.3 93.1 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.047 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -55.69 -53.18 59.68 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.738 0.304 . . . . 0.0 111.235 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -70.41 -36.78 74.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.204 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.93 -58.37 8.83 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -58.64 -47.05 85.73 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -61.04 -37.95 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.431 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.6 ttt-85 -68.51 -41.86 79.39 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.4 m -58.97 -34.52 71.9 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.995 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.408 ' HG ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -55.89 -44.27 78.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.254 0.346 . . . . 0.0 110.543 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -66.94 -42.67 84.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.117 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.95 -39.54 90.54 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.033 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -137.09 77.27 43.23 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.179 0.3 . . . . 0.0 110.465 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.17 -24.27 78.81 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.355 2.036 . . . . 0.0 112.266 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.7 p -61.76 -30.53 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.332 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -90.68 5.27 48.79 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 123.27 0.356 . . . . 0.0 110.905 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 p -40.15 -53.96 2.38 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.87 92.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.277 0.361 . . . . 0.0 110.972 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -67.76 -47.11 70.14 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.184 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.408 HD12 ' HG ' ' A' ' 34' ' ' LEU . 91.7 mt -58.44 -40.84 83.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.258 0.349 . . . . 0.0 111.046 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.2 tp -61.76 -48.09 82.25 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.07 -43.12 99.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.704 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -62.21 -38.98 91.23 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.682 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.28 96.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -63.45 -36.65 84.46 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.555 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -59.2 -43.89 92.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.377 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.692 HD22 HE22 ' A' ' 26' ' ' GLN . 77.9 mt -62.91 -43.81 97.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -61.35 -47.99 83.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -61.78 -38.35 87.73 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.533 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.43 -50.93 12.87 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -66.02 -27.85 68.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.18 144.82 58.9 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.192 0.308 . . . . 0.0 111.64 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.2 167.98 8.4 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 122.649 2.233 . . . . 0.0 112.021 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 CA--C 1.547 0.843 0 CA-C-O 117.436 -1.269 . . . . 0.0 110.762 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -74.13 -75.37 0.16 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.34 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.12 -61.3 1.71 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.738 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -171.9 147.97 2.25 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.205 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -79.81 58.0 2.71 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.548 0.69 . . . . 0.0 111.121 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -68.43 -30.13 68.95 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.563 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -54.45 -46.45 73.29 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -62.32 -37.54 85.97 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.469 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.54 -41.76 98.44 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.372 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.89 -39.1 87.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.418 0.449 . . . . 0.0 110.35 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -59.81 -54.84 41.54 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.772 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.9 70.36 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.167 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -54.76 -57.84 9.93 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.692 0.282 . . . . 0.0 111.232 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -69.24 -39.9 78.23 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.83 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -60.92 -40.5 93.4 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.122 0.263 . . . . 0.0 111.111 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 71.6 mt -64.7 -52.08 59.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.33 -29.07 68.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.393 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.18 -32.88 71.49 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.473 0.483 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.0 OUTLIER -56.34 136.82 75.73 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.186 -178.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -90.47 -42.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 123.597 2.864 . . . . 0.0 116.592 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.86 -0.48 57.59 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.451 HD11 HD12 ' A' ' 19' ' ' LEU . 95.9 mt -65.48 137.82 57.69 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.672 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -57.64 157.79 6.76 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -53.01 -51.28 62.17 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.12 -41.02 74.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.41 -42.47 91.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -59.78 -50.58 73.27 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.062 0.226 . . . . 0.0 111.003 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 -71.8 -32.08 67.24 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.414 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.02 -47.08 87.32 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -59.64 -53.11 61.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.89 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.0 mt -59.01 -39.87 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 122.977 0.173 . . . . 0.0 110.582 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.4 -43.95 92.79 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 120.968 0.413 . . . . 0.0 109.973 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.4 m -60.67 -32.68 71.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.82 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -46.97 76.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.097 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -64.59 -42.45 95.58 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.482 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.16 -36.9 81.05 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.49 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -151.51 88.41 4.32 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.587 0.232 . . . . 0.0 111.159 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -54.33 -24.92 36.74 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.755 2.303 . . . . 0.0 112.517 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -58.9 -33.6 70.72 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.449 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -86.35 1.23 51.91 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.7 p -40.03 -56.23 1.9 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.78 92.52 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.48 -47.47 66.99 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.594 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 36.8 mt -57.98 -41.5 83.12 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.408 0.443 . . . . 0.0 110.859 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.59 -50.76 71.32 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.89 83.22 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.023 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -61.76 -33.36 73.94 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.596 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -43.79 91.35 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -62.5 -36.41 82.44 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.197 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -63.35 -50.6 69.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.69 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.88 -41.98 99.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.463 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.627 ' HB2' HD13 ' A' ' 19' ' ' LEU . 4.4 t30 -60.65 -47.47 86.1 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.216 0.322 . . . . 0.0 110.389 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.95 -38.52 91.38 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.114 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.44 -51.42 13.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -66.0 -27.99 68.54 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.77 146.46 66.49 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 123.133 0.271 . . . . 0.0 111.131 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.74 159.93 50.52 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.881 2.387 . . . . 0.0 112.047 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.471 0.624 0 O-C-N 124.018 0.824 . . . . 0.0 110.932 -179.922 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -73.74 -74.96 0.16 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.556 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.44 -61.28 1.71 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.928 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -168.88 144.76 3.44 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.262 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -84.33 52.27 2.3 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.352 0.596 . . . . 0.0 111.093 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -85.22 -0.6 55.15 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.768 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -61.99 -48.59 79.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.074 0.464 . . . . 0.0 109.996 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -63.55 -35.95 82.18 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.123 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.2 mtt -61.69 -40.82 96.36 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.854 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -62.08 -42.65 99.43 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.395 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -59.66 -50.93 71.97 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.731 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.42 -29.71 67.5 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.002 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE2' HD13 ' A' ' 31' ' ' ILE . 55.9 t80 -56.9 -55.02 39.93 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.518 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -75.3 -36.19 61.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.86 -47.51 83.06 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.94 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.96 -50.39 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.267 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -30.66 64.89 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.543 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -60.13 -36.76 78.22 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.402 0.439 . . . . 0.0 111.822 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.32 119.9 57.15 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -87.71 -22.18 1.6 Allowed 'Trans proline' 0 N--CA 1.503 2.063 0 C-N-CA 123.569 2.846 . . . . 0.0 115.516 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -82.62 -6.1 59.17 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -177.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.9 mt -72.99 131.53 42.27 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.662 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.2 146.83 10.97 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.965 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -51.76 -41.44 61.61 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.0 -41.93 81.51 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.12 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.675 HE22 HD22 ' A' ' 51' ' ' LEU . 93.2 mt-30 -63.17 -40.29 97.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.988 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -59.45 -57.72 11.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.762 0.315 . . . . 0.0 110.611 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -62.09 -33.82 75.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.831 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.84 95.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.869 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -60.71 -59.51 5.27 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.447 HD13 ' CE2' ' A' ' 13' ' ' TYR . 71.7 mt -56.4 -44.58 80.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 123.323 0.39 . . . . 0.0 111.293 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -62.01 -49.2 76.98 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.646 0.26 . . . . 0.0 110.759 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -63.7 -26.45 68.66 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.414 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -47.27 86.32 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.511 0.507 . . . . 0.0 109.759 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.96 -42.81 97.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.875 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.6 -36.69 85.04 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.523 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -137.73 78.64 36.25 Favored Pre-proline 0 CA--C 1.541 0.597 0 O-C-N 123.333 0.396 . . . . 0.0 110.567 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.42 -19.87 66.12 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.406 2.071 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.8 m -61.39 -29.89 70.21 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.055 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -99.2 3.91 46.55 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.2 m -44.1 -40.47 4.94 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -47.11 72.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 110.26 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -63.52 -43.81 96.08 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.894 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -57.95 -40.89 81.64 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.187 0.305 . . . . 0.0 111.015 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.25 -45.88 92.67 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.63 94.73 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.568 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -61.32 -37.96 85.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.878 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.5 94.93 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -62.74 -35.52 80.05 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.744 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.06 -46.87 88.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.569 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.675 HD22 HE22 ' A' ' 26' ' ' GLN . 15.6 mt -63.33 -39.3 94.17 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.56 -48.84 77.73 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.014 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.06 -38.39 88.62 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.095 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.4 -51.13 18.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.938 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -65.96 -27.04 67.86 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.753 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 148.52 29.73 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.126 0.266 . . . . 0.0 111.46 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.42 158.12 58.97 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.787 2.325 . . . . 0.0 112.045 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.02 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.64 -74.06 0.1 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.903 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -89.48 -60.64 1.89 Allowed 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.2 tttp -176.43 153.92 1.24 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.106 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -78.67 55.85 1.74 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.433 0.635 . . . . 0.0 111.872 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -70.79 -31.18 67.86 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.406 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -54.88 -44.5 74.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.52 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -61.68 -38.81 89.17 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.906 0.384 . . . . 0.0 110.26 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.75 -41.07 98.07 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.463 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -60.45 -38.95 85.81 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.33 0.394 . . . . 0.0 110.549 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -62.39 -51.36 67.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.658 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.11 -32.17 71.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.857 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -55.01 -61.48 2.28 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.004 0.43 . . . . 0.0 110.928 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.1 t90 -69.69 -42.01 74.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.686 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -57.93 -45.29 86.78 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.169 0.293 . . . . 0.0 111.282 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.2 -43.89 95.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.19 -28.84 67.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.2 tp -60.78 -36.37 78.8 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 123.357 0.411 . . . . 0.0 111.199 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.26 120.39 61.37 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -88.27 -20.35 1.77 Allowed 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 123.786 2.99 . . . . 0.0 116.289 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.3 p30 -91.42 -0.47 57.64 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 mt -71.53 137.62 48.25 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.414 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -57.14 148.63 21.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.031 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -52.55 -38.5 59.97 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.168 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -73.28 -39.45 65.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.33 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.469 HE22 HD22 ' A' ' 51' ' ' LEU . 92.0 mt-30 -66.28 -45.59 79.95 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -59.09 -43.01 91.8 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -72.37 -40.72 67.07 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.751 0.31 . . . . 0.0 110.764 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.8 97.73 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.243 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -61.8 -54.31 43.97 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.5 mt -60.77 -31.93 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -72.28 -42.76 65.18 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.055 0.455 . . . . 0.0 110.174 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.6 p -62.29 -26.08 68.21 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.438 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.418 HD22 HD13 ' A' ' 44' ' ' LEU . 1.4 mm? -53.51 -46.14 69.99 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 178.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.1 -39.75 71.91 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.152 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.79 -42.9 90.15 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.46 0.475 . . . . 0.0 111.963 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 82.59 9.23 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-O 120.872 0.368 . . . . 0.0 110.924 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -56.16 -20.15 30.03 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 122.856 2.371 . . . . 0.0 112.339 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.7 p -63.49 -27.7 69.46 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.735 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -99.58 5.11 46.04 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -43.49 -43.95 5.7 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.15 -46.24 81.68 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.879 0.371 . . . . 0.0 110.516 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.62 -43.93 92.15 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.323 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.418 HD13 HD22 ' A' ' 34' ' ' LEU . 82.9 mt -58.39 -42.74 87.75 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.277 0.36 . . . . 0.0 111.028 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.4 tp -60.51 -50.83 71.97 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.46 96.67 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -62.04 -36.49 81.76 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.442 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.69 98.78 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -64.12 -36.09 82.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.685 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -59.83 -44.76 93.88 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.227 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.469 HD22 HE22 ' A' ' 26' ' ' GLN . 85.4 mt -60.7 -44.83 96.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.931 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -60.66 -48.56 81.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.544 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.06 -38.42 86.12 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.417 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.03 -51.49 12.22 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.48 -27.85 68.79 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.24 145.81 54.93 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 123.155 0.284 . . . . 0.0 111.435 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.98 164.65 26.55 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.862 2.375 . . . . 0.0 111.791 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.398 -0.811 . . . . 0.0 111.112 179.874 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.6 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -89.39 179.54 6.06 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.779 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -53.98 -25.2 19.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.536 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.95 -42.02 2.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.215 0.606 . . . . 0.0 111.953 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -57.02 13.35 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.869 -178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.8 -41.07 88.16 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -57.99 -59.94 4.49 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -177.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.44 -38.6 87.75 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.576 0.227 . . . . 0.0 111.478 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.0 ttm -61.51 -54.49 42.56 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.273 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.06 -39.1 71.55 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.265 0.353 . . . . 0.0 111.718 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -58.64 -62.77 1.62 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 121.097 -0.241 . . . . 0.0 111.192 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.19 -27.25 67.11 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.73 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -56.53 -59.81 4.44 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.603 0.24 . . . . 0.0 111.07 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -70.58 -39.18 74.02 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.85 -41.49 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.277 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -68.61 -48.78 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.75 -29.38 66.7 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.267 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.57 -36.81 76.94 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.345 0.403 . . . . 0.0 111.332 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.13 121.71 73.39 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -87.6 -21.84 1.72 Allowed 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.57 2.847 . . . . 0.0 116.186 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -91.91 -1.09 57.47 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.1 mt -70.28 137.09 50.44 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.398 178.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -58.64 145.66 39.01 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.38 -40.35 68.09 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -65.7 -45.28 83.39 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.481 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -63.62 -35.95 82.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.58 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -61.32 -61.76 2.32 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.538 0.524 . . . . 0.0 110.004 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -60.05 -38.18 82.03 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.15 87.65 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -61.58 -60.82 3.11 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.172 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -56.06 -40.06 61.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 123.351 0.407 . . . . 0.0 111.637 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -62.33 -49.84 74.01 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 m -62.36 -32.69 73.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.815 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.72 -44.79 90.53 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.076 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -63.43 -42.75 98.69 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.694 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.72 -36.96 82.46 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.211 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -147.65 86.39 6.29 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.167 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -60.95 -14.82 34.94 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 122.397 2.065 . . . . 0.0 112.253 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 t -57.81 -32.07 67.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.211 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -92.79 2.36 56.79 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.194 0.309 . . . . 0.0 111.415 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 60.7 p -44.32 -49.85 9.3 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.9 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -69.97 -48.8 56.83 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.127 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -58.28 -41.99 85.55 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.206 0.316 . . . . 0.0 110.905 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.4 -48.51 80.91 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.95 -41.18 97.68 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.674 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.14 -39.96 95.14 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.549 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.51 87.64 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -64.07 -38.21 90.25 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -62.58 -43.59 98.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.111 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.16 -47.26 85.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.485 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.4 -48.76 80.4 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.299 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.13 -38.6 83.54 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.067 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -51.28 15.54 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.967 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -66.18 -27.91 68.36 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.901 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.37 144.77 50.72 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.259 0.349 . . . . 0.0 111.735 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.96 154.88 42.99 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 123.141 2.561 . . . . 0.0 112.356 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 118.121 -0.942 . . . . 0.0 110.543 179.719 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 51.2 t . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.85 152.39 31.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.15 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -55.25 -23.2 21.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.637 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.1 -39.49 42.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.041 0.536 . . . . 0.0 112.192 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -61.77 2.35 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.135 0.272 . . . . 0.0 111.343 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -63.48 -34.46 77.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.209 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -59.91 -57.35 13.26 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -178.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.6 -41.57 98.32 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.437 ' SD ' HD12 ' A' ' 34' ' ' LEU . 3.5 tpp -61.08 -48.61 80.92 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.892 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -58.21 -39.92 80.28 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.452 0.47 . . . . 0.0 111.214 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -59.58 -59.59 5.19 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.576 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.29 69.29 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.433 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -54.83 -61.2 2.46 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.867 0.365 . . . . 0.0 111.314 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.3 t90 -66.87 -41.96 86.42 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.781 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -59.67 -43.7 93.86 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.211 0.319 . . . . 0.0 111.352 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.27 -47.7 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.35 -26.36 64.98 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.309 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.24 -32.91 70.4 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 123.436 0.46 . . . . 0.0 111.74 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.1 mt -57.34 138.45 80.88 Favored Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.816 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -90.13 -43.97 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 123.518 2.812 . . . . 0.0 116.516 -176.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -86.8 -2.69 58.77 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -175.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.505 HD11 HD12 ' A' ' 19' ' ' LEU . 89.8 mt -66.9 132.25 47.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.294 -0.962 . . . . 0.0 109.143 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -57.0 158.28 5.07 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.834 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -56.32 -41.21 75.65 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.797 0.332 . . . . 0.0 111.044 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.69 -41.46 71.95 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.761 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -61.22 -42.58 98.85 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.047 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.04 -54.41 45.2 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.105 0.478 . . . . 0.0 110.165 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -61.58 -34.69 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.9 71.63 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -60.12 -53.3 59.39 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.471 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.78 -34.06 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.837 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -64.37 -44.48 91.26 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 t -61.5 -31.53 71.53 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.174 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -53.39 -52.07 60.51 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.201 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.6 -39.4 93.63 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.197 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -58.38 -38.62 77.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.999 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.91 105.35 0.72 Allowed Pre-proline 0 CA--C 1.542 0.673 0 O-C-N 123.138 0.274 . . . . 0.0 111.062 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.36 -16.77 56.63 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.836 1.691 . . . . 0.0 111.067 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.2 m -57.57 -33.26 67.97 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.995 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -92.88 -3.05 55.28 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 123.192 0.308 . . . . 0.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.6 t -46.01 -38.04 7.34 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.69 73.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -67.88 -47.86 67.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.157 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.439 HD12 HD22 ' A' ' 34' ' ' LEU . 53.3 mt -56.12 -43.73 78.44 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.335 0.397 . . . . 0.0 111.018 -178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.8 tp -61.52 -50.8 71.23 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.04 84.74 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.94 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -62.59 -35.64 80.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.049 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -43.89 97.76 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -62.91 -38.42 90.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.08 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -62.23 -45.09 94.87 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.112 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -44.93 95.35 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.724 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.594 ' HB2' HD13 ' A' ' 19' ' ' LEU . 1.7 t30 -59.17 -47.05 86.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.333 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.86 -36.79 82.28 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -52.0 27.6 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.278 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.437 HE22 ' HA ' ' A' ' 22' ' ' LEU . 26.9 mt-30 -72.04 -27.41 62.68 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.69 145.12 63.01 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.104 0.252 . . . . 0.0 111.474 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.6 170.0 4.87 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.694 2.263 . . . . 0.0 112.007 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp . . . . . 0 CA--C 1.548 0.882 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.673 179.801 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.651 HG22 ' HB3' ' A' ' 4' ' ' LYS . 16.9 m . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.503 ' N ' HG23 ' A' ' 1' ' ' VAL . 48.8 m-20 -63.46 -74.25 0.1 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -90.13 -34.96 15.68 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.651 ' HB3' HG22 ' A' ' 1' ' ' VAL . 0.2 OUTLIER -73.24 -158.23 0.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.576 -178.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -90.73 119.31 30.85 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.231 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -93.31 -38.18 11.64 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.165 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.63 -42.77 75.44 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.813 -178.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -58.32 -38.37 76.99 Favored 'General case' 0 C--O 1.237 0.433 0 O-C-N 123.25 0.344 . . . . 0.0 110.949 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -50.44 67.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.476 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -60.26 -37.04 79.2 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.349 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.6 -60.96 2.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.74 -31.63 72.94 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.288 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -56.01 -60.16 3.88 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.882 0.372 . . . . 0.0 111.038 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -68.76 -42.04 78.02 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.706 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -57.63 -46.85 83.62 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.281 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.5 mt -64.18 -45.98 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.65 -25.23 62.53 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.392 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.17 -37.34 74.53 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.762 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.455 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.2 mm? -72.65 120.24 79.6 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.208 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -89.04 -20.93 1.35 Allowed 'Trans proline' 0 N--CA 1.502 2.019 0 C-N-CA 123.666 2.91 . . . . 0.0 115.523 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.2 p30 -83.78 -2.57 56.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 mt -73.09 130.4 40.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.516 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -49.89 147.11 4.04 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.815 0.697 . . . . 0.0 110.526 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -47.72 -43.15 26.69 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -68.9 -44.5 73.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.647 0.261 . . . . 0.0 110.938 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.626 HE22 HD22 ' A' ' 51' ' ' LEU . 95.0 mt-30 -59.88 -38.23 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.186 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -58.01 -56.05 27.07 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -71.64 -31.95 67.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.775 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.19 66.77 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -61.84 -54.25 44.71 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.0 mt -58.85 -43.05 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 123.041 0.213 . . . . 0.0 111.142 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.61 -45.81 92.5 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.908 0.385 . . . . 0.0 110.145 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 m -60.88 -31.65 71.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.553 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -47.44 83.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.425 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.11 -42.01 99.48 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.75 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.31 -35.2 78.31 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.338 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -144.59 83.64 9.61 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 123.126 0.266 . . . . 0.0 110.739 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.99 -24.6 49.43 Favored 'Trans proline' 0 N--CA 1.5 1.91 0 C-N-CA 122.652 2.235 . . . . 0.0 112.508 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -59.67 -30.67 68.93 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.751 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -96.34 5.09 51.68 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -45.41 -38.57 6.13 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.77 73.48 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.806 0.336 . . . . 0.0 110.619 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -67.14 -48.72 67.2 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.482 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.83 -42.65 80.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.172 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.77 -48.97 79.4 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.01 96.98 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.898 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -64.4 -39.76 94.49 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.863 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.19 90.75 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -63.21 -32.86 74.37 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.977 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.19 -46.54 89.39 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.189 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.626 HD22 HE22 ' A' ' 26' ' ' GLN . 6.2 mt -64.45 -38.0 89.49 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.157 178.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.93 -48.5 81.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.872 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.31 -37.58 88.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.147 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.42 -52.3 23.28 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.412 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -70.17 -27.64 64.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.271 -178.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.86 5.27 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 123.272 0.358 . . . . 0.0 111.718 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.42 156.96 9.99 Favored 'Trans proline' 0 N--CA 1.503 2.048 0 C-N-CA 123.15 2.566 . . . . 0.0 113.13 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.1 mmtp . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.414 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -83.06 -170.09 2.85 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.248 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -55.74 -23.04 26.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.007 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.75 -40.53 6.12 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.389 0.431 . . . . 0.0 111.879 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -55.27 28.61 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.456 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -66.38 -38.66 88.03 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -55.02 -66.71 0.36 Allowed 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.56 -38.1 80.21 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.126 0.266 . . . . 0.0 111.704 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.6 ttm -61.0 -52.49 64.8 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.142 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -59.32 -36.41 75.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 123.273 0.358 . . . . 0.0 111.799 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -60.33 -60.94 3.02 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.116 0.26 . . . . 0.0 111.375 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.83 -28.18 66.5 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.463 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -56.39 -61.61 2.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.886 0.374 . . . . 0.0 111.085 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -67.45 -42.03 83.73 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.187 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -60.2 -46.22 90.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.118 0.261 . . . . 0.0 111.569 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.45 -48.33 85.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 121.061 -0.255 . . . . 0.0 110.372 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.8 65.59 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.424 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.3 tp -58.7 -35.93 73.43 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.447 0.467 . . . . 0.0 111.608 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.79 120.85 64.07 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -87.89 -22.08 1.56 Allowed 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 123.721 2.948 . . . . 0.0 116.403 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -89.37 -0.69 57.67 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -177.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.3 mt -72.95 138.86 46.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.692 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -58.25 144.07 42.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.331 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -49.67 -42.69 46.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -68.09 -41.08 82.42 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.095 0.247 . . . . 0.0 111.309 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.566 HE22 HD22 ' A' ' 51' ' ' LEU . 96.2 mt-30 -63.2 -38.05 89.65 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.157 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -59.17 -60.94 3.06 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 -62.16 -33.5 74.62 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.117 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.983 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -60.17 -61.48 2.58 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.657 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.455 HD13 ' CD2' ' A' ' 13' ' ' TYR . 54.2 mt -53.44 -43.16 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -61.25 -46.86 88.64 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.206 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.7 m -63.88 -33.7 76.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.61 -44.06 96.74 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.707 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -61.62 -40.72 95.84 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.617 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.66 -37.38 83.84 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.848 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.65 96.6 2.97 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.139 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.69 -16.34 52.34 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.089 1.859 . . . . 0.0 111.395 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.4 m -58.1 -32.63 68.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.822 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -89.12 -3.63 58.58 Favored 'General case' 0 C--O 1.225 -0.184 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.217 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 t -46.96 -39.52 12.55 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.26 -45.13 85.8 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.06 -48.07 66.61 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.285 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.9 mt -58.93 -42.69 90.36 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.234 0.334 . . . . 0.0 110.949 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.18 -48.65 80.85 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.057 0.456 . . . . 0.0 109.816 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.0 -43.4 98.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.7 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -61.08 -36.78 80.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.907 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.64 -44.43 90.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -61.9 -35.27 77.86 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.783 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -60.5 -45.47 93.66 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.097 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.566 HD22 HE22 ' A' ' 26' ' ' GLN . 12.9 mt -65.38 -40.74 93.87 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.025 179.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -60.59 -48.68 80.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.342 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.63 -38.58 90.81 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.397 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.96 -51.44 13.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.43 -27.43 67.83 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.895 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.43 142.97 48.79 Favored Pre-proline 0 N--CA 1.47 0.566 0 CA-C-O 120.846 0.355 . . . . 0.0 111.874 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.92 169.36 7.47 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.44 2.093 . . . . 0.0 112.013 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.645 179.207 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.89 -75.08 0.15 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.399 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -90.65 -61.44 1.67 Allowed 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.212 0.32 . . . . 0.0 110.963 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -168.97 142.92 2.97 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.303 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -83.34 45.79 1.07 Allowed 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.222 0.534 . . . . 0.0 111.375 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.531 ' H ' HD22 ' A' ' 6' ' ' ASN . 1.8 p30 -85.12 -1.74 57.22 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -59.86 -46.53 89.01 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-O 120.945 0.403 . . . . 0.0 110.398 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -62.35 -35.27 78.58 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.149 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 58.2 mtt -62.21 -40.65 96.82 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -62.33 -41.83 98.89 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.72 -50.28 71.71 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.035 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.73 -34.93 77.82 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.04 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -55.48 -51.89 65.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.973 0.416 . . . . 0.0 110.802 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -66.04 -45.7 80.47 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.498 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -60.18 -40.7 90.93 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.743 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.68 -55.34 23.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.06 -31.44 65.21 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.458 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -61.71 -37.42 84.09 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.355 0.41 . . . . 0.0 111.153 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -67.58 121.21 78.18 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -87.2 -34.43 0.13 Allowed 'Trans proline' 0 N--CA 1.502 1.981 0 C-N-CA 123.346 2.698 . . . . 0.0 114.817 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -61.84 -20.31 63.53 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.134 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.92 127.35 31.68 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.036 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -50.18 147.13 4.37 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.072 0.857 . . . . 0.0 110.089 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -50.38 -39.83 47.84 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.53 -41.85 71.99 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.473 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.6 HE22 HD22 ' A' ' 51' ' ' LEU . 89.4 mt-30 -61.2 -38.48 86.74 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -54.51 -63.51 1.13 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.923 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -61.52 -33.38 73.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.248 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.82 -59.35 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -61.21 -44.77 96.76 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.63 -42.0 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.098 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 46.5 mmm-85 -77.61 -33.73 53.61 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.504 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.4 p -58.13 -31.82 67.56 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.708 -0.224 . . . . 0.0 110.92 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -41.42 86.06 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.708 0.289 . . . . 0.0 110.395 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -65.35 -44.1 88.75 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.579 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.8 -38.39 81.79 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.556 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.54 88.63 3.95 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.521 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.0 -18.69 64.68 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.292 1.995 . . . . 0.0 111.982 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -60.88 -24.53 66.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.482 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.63 6.65 45.63 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.8 m -41.41 -47.44 3.61 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.84 -44.0 86.84 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -65.56 -44.89 85.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.307 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.8 mt -58.87 -42.55 89.69 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.297 0.373 . . . . 0.0 111.151 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.9 tp -60.82 -47.92 84.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.38 -43.09 99.64 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.669 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -61.75 -37.42 84.21 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.876 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.22 92.22 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -63.03 -36.22 82.85 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.652 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.18 -44.07 92.17 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.6 HD22 HE22 ' A' ' 26' ' ' GLN . 75.9 mt -62.02 -43.06 99.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.956 178.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.07 -47.98 83.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.57 -38.83 88.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.221 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.65 -51.33 17.11 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.161 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -65.95 -27.25 68.02 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.878 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.35 145.74 35.6 Favored Pre-proline 0 N--CA 1.472 0.668 0 O-C-N 123.112 0.257 . . . . 0.0 111.597 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -74.78 153.49 42.97 Favored 'Trans proline' 0 N--CA 1.499 1.826 0 C-N-CA 122.858 2.372 . . . . 0.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.488 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -71.56 -72.88 0.2 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.408 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -90.56 -61.49 1.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.932 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -170.33 149.94 3.49 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.241 0.338 . . . . 0.0 110.189 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -81.0 55.88 2.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.576 0.703 . . . . 0.0 111.181 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -64.83 -34.95 79.58 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.217 179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -54.92 -48.68 72.78 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.507 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -62.73 -34.11 76.52 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.8 ttm -61.72 -47.2 86.35 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.198 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.44 -37.12 82.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.776 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -59.1 -54.81 42.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.952 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.38 68.44 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 121.205 -0.198 . . . . 0.0 111.161 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -55.44 -63.87 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.812 0.339 . . . . 0.0 111.271 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.79 -36.78 78.7 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.843 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -58.68 -42.76 89.28 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.184 -0.207 . . . . 0.0 110.92 -179.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 84.5 mt -65.95 -46.92 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -30.16 66.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.314 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.01 -36.2 76.7 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.296 0.372 . . . . 0.0 111.581 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.01 120.32 62.97 Favored Pre-proline 0 CA--C 1.543 0.673 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -88.48 -26.28 0.61 Allowed 'Trans proline' 0 N--CA 1.502 2.008 0 C-N-CA 123.717 2.945 . . . . 0.0 116.327 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 p30 -85.36 -1.78 57.37 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.2 mt -70.44 139.25 51.73 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -55.92 140.67 42.06 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.451 0.469 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -45.9 -40.08 9.6 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -70.36 -45.07 66.82 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.238 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.564 HE22 HD22 ' A' ' 51' ' ' LEU . 91.4 mt-30 -60.59 -38.14 83.65 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.129 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -54.93 -55.84 26.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.476 0.179 . . . . 0.0 111.31 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.3 mtt85 -71.1 -33.31 70.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.216 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.75 -57.9 10.91 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -59.74 -46.0 90.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.23 -39.53 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -67.55 -42.22 83.0 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.881 0.372 . . . . 0.0 110.175 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -60.08 -35.15 74.54 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.035 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.41 -51.31 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 123.356 0.41 . . . . 0.0 110.761 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.85 -42.52 97.56 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.973 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.63 -37.76 85.18 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.674 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -142.17 79.31 16.15 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 123.159 0.287 . . . . 0.0 110.965 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -55.35 -25.09 46.06 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.79 2.327 . . . . 0.0 112.534 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -59.92 -31.27 69.67 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.464 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -91.94 4.11 53.72 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.256 0.347 . . . . 0.0 111.405 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.5 p -40.02 -55.28 2.09 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.78 -39.0 92.85 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.123 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -68.4 -49.21 61.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.48 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.27 -41.42 79.68 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.286 0.366 . . . . 0.0 111.15 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -61.86 -49.7 75.2 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.39 96.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.821 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -63.34 -38.3 90.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.585 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.69 -42.47 95.31 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -63.25 -36.13 82.65 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.584 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -59.73 -44.52 93.74 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.147 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.564 HD22 HE22 ' A' ' 26' ' ' GLN . 77.4 mt -62.92 -42.78 99.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.976 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -60.95 -48.23 82.77 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.338 178.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -62.05 -38.59 89.32 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.435 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.92 -51.46 12.4 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -66.32 -27.88 68.25 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.75 150.91 24.77 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.179 0.3 . . . . 0.0 111.601 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.67 153.61 69.15 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 122.927 2.418 . . . . 0.0 112.224 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.8 mptt . . . . . 0 C--O 1.221 -0.404 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.4 -179.866 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 60.9 t . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -69.29 -73.19 0.16 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.02 -61.23 1.73 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 109.984 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -173.72 152.54 2.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.231 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -80.38 65.79 5.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.537 0.684 . . . . 0.0 111.279 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -86.65 -7.02 58.68 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.71 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -61.9 -52.81 62.58 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 120.747 0.308 . . . . 0.0 111.053 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -61.11 -33.99 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.538 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.13 -42.94 99.61 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -62.73 -38.88 92.24 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -63.31 -52.77 60.55 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.131 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.42 74.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.037 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -55.97 -56.06 25.27 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.994 0.426 . . . . 0.0 110.988 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -69.97 -43.37 71.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.657 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -58.45 -47.93 82.38 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.277 0.361 . . . . 0.0 111.476 -178.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -63.58 -49.64 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.19 -30.47 66.47 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.523 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -60.52 -36.03 77.39 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.86 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.03 120.4 63.73 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.206 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -87.84 -18.22 2.45 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.606 2.871 . . . . 0.0 115.672 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -87.83 -5.19 58.73 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.2 mt -74.03 132.08 42.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.792 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -54.89 151.5 8.58 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.985 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -54.47 -39.93 67.95 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.78 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -71.65 -45.55 61.65 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.068 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.498 HE22 HD22 ' A' ' 51' ' ' LEU . 94.6 mt-30 -61.26 -45.15 95.69 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.071 -178.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.05 -52.18 66.46 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.174 0.296 . . . . 0.0 111.11 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -66.21 -33.84 76.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.271 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.77 96.73 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.18 -0.463 . . . . 0.0 112.172 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -61.29 -62.07 2.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.8 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.5 mt -56.21 -41.85 71.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 123.119 0.262 . . . . 0.0 111.527 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -62.79 -51.01 68.78 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 120.964 0.411 . . . . 0.0 110.306 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 89.5 p -64.05 -23.9 67.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.245 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -46.51 89.68 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -64.3 -44.47 91.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.371 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -61.41 -38.27 86.48 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.303 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -135.59 81.54 41.6 Favored Pre-proline 0 CA--C 1.549 0.909 0 O-C-N 123.398 0.436 . . . . 0.0 110.347 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -63.18 -17.46 60.25 Favored 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 121.909 1.739 . . . . 0.0 112.461 -179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.7 p -65.2 -26.59 68.2 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.23 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -101.96 4.44 39.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.7 m -45.05 -38.91 5.26 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.31 -45.98 74.9 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.702 0.286 . . . . 0.0 110.346 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.68 -46.06 80.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.7 -41.24 81.3 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.336 0.397 . . . . 0.0 111.014 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.9 tp -61.08 -49.02 79.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.9 99.56 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.821 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -61.37 -39.31 90.17 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.841 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.46 97.42 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -65.3 -35.67 81.72 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.711 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -59.39 -47.35 85.77 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.54 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.498 HD22 HE22 ' A' ' 26' ' ' GLN . 13.1 mt -63.66 -38.16 90.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.19 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -48.67 78.14 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.869 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.21 -38.54 89.55 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.14 -51.25 18.63 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.092 -178.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.29 -26.18 67.2 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.912 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.31 145.9 34.49 Favored Pre-proline 0 N--CA 1.471 0.611 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.16 153.5 46.29 Favored 'Trans proline' 0 N--CA 1.498 1.78 0 C-N-CA 122.926 2.417 . . . . 0.0 112.376 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 89.7 mttt . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.524 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -75.12 0.09 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -89.89 -60.93 1.8 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -173.02 152.64 2.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.172 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 15.0 p90 -79.23 58.65 2.59 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.488 0.661 . . . . 0.0 112.099 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 41.5 m-20 -70.95 -29.81 65.93 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.204 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.32 -43.87 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.252 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.99 -40.13 92.32 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.4 mtt -64.4 -38.68 91.87 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.163 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -59.76 -40.0 86.69 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.308 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -64.33 -54.99 24.39 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.53 -34.0 76.82 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.933 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CE2' HD13 ' A' ' 31' ' ' ILE . 35.6 t80 -57.88 -57.55 12.3 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.856 0.36 . . . . 0.0 111.439 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -68.99 -44.95 71.82 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.436 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -59.44 -46.4 88.84 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.606 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.55 -42.85 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.296 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.22 -32.57 70.08 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.084 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.54 -33.76 76.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.719 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -61.99 119.12 45.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 122.958 0.161 . . . . 0.0 111.115 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -89.59 -42.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 123.583 2.855 . . . . 0.0 114.796 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.86 -36.82 75.22 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.6 HD11 ' HA ' ' A' ' 52' ' ' ASN . 8.6 mp -63.62 130.43 44.25 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.326 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -51.12 146.94 5.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.407 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -53.78 -38.07 64.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.652 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.64 -43.04 99.81 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.364 0.415 . . . . 0.0 110.457 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.569 ' NE2' HD13 ' A' ' 51' ' ' LEU . 82.2 mt-30 -65.65 -43.48 89.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.361 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -62.68 -50.93 69.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.578 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -62.06 -40.97 97.59 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.681 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.61 -34.46 77.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.791 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -63.41 -59.07 5.16 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.175 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.534 HD13 ' CE2' ' A' ' 13' ' ' TYR . 63.6 mt -61.74 -32.99 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.704 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.09 -46.36 71.2 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.216 0.532 . . . . 0.0 109.683 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 96.5 p -64.99 -21.93 66.92 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.993 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.461 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -59.62 -48.64 80.86 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.778 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -66.35 -41.8 89.02 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.716 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.76 -36.82 84.29 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.385 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -147.66 78.6 9.86 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.228 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.61 -27.73 85.35 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.544 2.163 . . . . 0.0 112.437 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 m -58.99 -30.34 67.9 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.703 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.8 5.76 44.68 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.5 t -45.51 -38.09 5.97 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.3 0.5 . . . . 0.0 111.777 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.06 -46.52 70.84 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.319 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -66.88 -45.84 76.83 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 34' ' ' LEU . 97.7 mt -57.11 -41.66 79.39 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.546 0.529 . . . . 0.0 110.99 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.72 -49.21 75.97 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.59 81.97 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.839 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -62.5 -32.88 73.87 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.488 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.13 -41.75 90.04 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -61.44 -35.21 76.96 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.891 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.42 -51.31 66.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.03 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.569 HD13 ' NE2' ' A' ' 26' ' ' GLN . 89.1 mt -63.51 -39.46 94.49 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.045 179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.6 ' HA ' HD11 ' A' ' 22' ' ' LEU . 39.9 t30 -56.64 -47.93 78.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.08 -31.88 72.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.389 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -53.12 34.69 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -80.89 -26.24 36.97 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.73 157.17 8.06 Favored Pre-proline 0 N--CA 1.472 0.667 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.94 159.05 4.13 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 123.0 2.467 . . . . 0.0 112.464 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt . . . . . 0 CA--C 1.546 0.819 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.604 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.46 -71.06 0.19 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.018 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -90.06 -61.61 1.65 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.314 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -174.25 148.62 1.31 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.351 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -83.54 48.25 1.39 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.311 0.577 . . . . 0.0 111.314 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.476 ' H ' HD22 ' A' ' 6' ' ' ASN . 2.2 p30 -84.84 -2.05 57.25 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.993 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -60.19 -48.19 82.76 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.966 0.413 . . . . 0.0 110.348 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.87 -35.03 77.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.319 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.9 mtt -62.04 -41.55 98.24 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.246 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -62.33 -42.94 99.79 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.348 0.405 . . . . 0.0 109.926 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -61.92 -50.3 72.71 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.35 -31.77 71.4 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.017 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -56.19 -56.62 18.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.819 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.73 -41.28 79.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.069 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -58.67 -42.88 89.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 121.176 -0.209 . . . . 0.0 111.451 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.32 -52.2 55.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.98 68.1 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.402 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.2 tp -60.59 -36.48 78.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.598 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.12 119.67 71.6 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -88.18 -24.22 1.02 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 123.651 2.901 . . . . 0.0 115.69 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.6 -6.3 58.09 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.6 mt -71.7 132.2 44.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.941 -0.703 . . . . 0.0 109.202 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -51.73 151.96 3.11 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.712 0.633 . . . . 0.0 110.926 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -50.95 -40.79 58.26 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -74.93 -48.04 26.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.849 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.42 HE22 HD22 ' A' ' 51' ' ' LEU . 95.6 mt-30 -59.73 -45.7 91.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.226 -178.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 ttmm -56.59 -47.36 79.74 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.287 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -79.54 -32.13 42.14 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.873 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -45.56 91.54 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -59.24 -58.63 7.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.544 -0.462 . . . . 0.0 112.054 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -54.94 -46.05 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 O-C-N 123.094 0.246 . . . . 0.0 111.557 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -62.88 -47.24 84.16 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.767 0.318 . . . . 0.0 110.547 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -61.22 -30.61 70.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.002 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -44.89 92.58 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.07 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.24 -39.53 94.14 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.575 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -67.14 -38.45 85.57 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.706 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -140.06 74.82 30.35 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.225 0.328 . . . . 0.0 110.454 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.87 -16.41 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 112.428 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.2 m -61.48 -29.71 70.14 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.15 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -105.06 9.71 34.27 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.8 m -44.29 -35.08 2.16 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.21 69.39 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.204 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -37.03 72.66 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.24 -178.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.08 -44.46 96.63 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.64 -48.43 81.81 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.74 91.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.846 178.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -63.72 -37.24 86.61 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.806 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.31 93.81 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -63.5 -35.65 81.17 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.943 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -59.13 -47.99 83.26 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.571 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.42 HD22 HE22 ' A' ' 26' ' ' GLN . 12.2 mt -63.32 -38.84 92.72 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.174 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.52 -48.26 80.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.885 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.46 -38.48 89.99 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.086 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.28 -51.26 15.8 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -65.37 -26.84 68.19 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.37 157.31 4.97 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.15 0.281 . . . . 0.0 111.672 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.2 156.51 5.27 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 123.101 2.534 . . . . 0.0 112.954 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.883 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 2' ' ' ASP . 17.7 t . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.453 ' N ' HG12 ' A' ' 1' ' ' VAL . 11.1 t70 -62.7 138.55 58.54 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -54.21 -23.21 13.76 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.613 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -25.36 17.42 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -85.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -52.04 -35.73 48.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.14 -67.08 0.42 Allowed 'General case' 0 C--O 1.24 0.574 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -61.1 -39.26 89.27 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.498 ' SD ' ' CD2' ' A' ' 34' ' ' LEU . 1.6 mmm -62.8 -43.27 99.23 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.932 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -60.18 -40.11 88.84 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.293 0.37 . . . . 0.0 110.571 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -59.64 -55.85 29.26 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.305 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.68 -29.99 66.44 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -57.24 -59.67 4.76 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.867 0.365 . . . . 0.0 111.179 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -67.85 -42.55 81.22 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.121 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.25 -46.44 89.79 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.129 0.268 . . . . 0.0 111.52 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.48 -47.44 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.274 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.4 -29.38 66.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.533 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -59.88 -36.73 77.54 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 123.264 0.352 . . . . 0.0 111.471 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 120.98 69.4 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -86.88 -34.44 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.258 2.639 . . . . 0.0 114.652 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -19.29 65.43 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 13.1 mt -64.0 132.1 49.6 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.938 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' H ' HE22 ' A' ' 55' ' ' GLN . 23.7 t-20 -55.58 143.18 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -50.23 -39.14 43.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -67.03 -43.95 81.48 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.86 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.466 HE22 HD22 ' A' ' 51' ' ' LEU . 89.1 mt-30 -62.5 -36.96 84.17 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.883 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -59.31 -62.94 1.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 110.694 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.29 -34.94 74.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.15 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.15 -48.45 81.56 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.412 0.445 . . . . 0.0 111.986 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.56 -61.43 2.59 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.253 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.46 HD13 ' CD2' ' A' ' 13' ' ' TYR . 51.4 mt -54.51 -39.42 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 O-C-N 123.336 0.397 . . . . 0.0 111.963 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.84 -50.49 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.7 m -63.53 -34.93 78.87 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.829 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' CD2' ' SD ' ' A' ' 9' ' ' MET . 3.9 tt -59.11 -42.22 90.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.955 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -63.11 -45.42 92.09 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.53 -36.76 85.25 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.452 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -139.14 82.0 20.21 Favored Pre-proline 0 CA--C 1.545 0.761 0 O-C-N 123.334 0.396 . . . . 0.0 111.521 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.7 -17.38 49.26 Favored 'Trans proline' 0 N--CA 1.505 2.149 0 C-N-CA 122.499 2.132 . . . . 0.0 111.993 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.7 m -57.26 -33.78 67.96 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.288 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -91.62 -0.59 57.59 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 123.187 0.304 . . . . 0.0 111.521 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.6 t -46.11 -37.78 7.28 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 117.694 0.224 . . . . 0.0 111.579 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -45.51 70.5 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -66.82 -47.27 72.53 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.051 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.52 -40.45 82.93 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.305 0.378 . . . . 0.0 110.752 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 15.4 tp -61.02 -49.04 79.01 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.703 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -61.44 -38.16 86.15 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.655 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.1 96.43 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 tttt -64.52 -37.57 88.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.161 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -60.65 -44.3 96.59 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.794 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.466 HD22 HE22 ' A' ' 26' ' ' GLN . 78.1 mt -62.45 -44.57 96.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.508 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.5 -48.14 82.79 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.401 179.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.25 -37.95 84.95 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.036 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.01 17.42 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.954 -178.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.444 HE22 ' H ' ' A' ' 23' ' ' ASN . 52.5 mt-30 -65.34 -27.25 68.46 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.894 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -52.92 151.76 8.11 Favored Pre-proline 0 N--CA 1.475 0.777 0 O-C-N 123.213 0.321 . . . . 0.0 111.835 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.4 170.41 4.22 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.742 2.294 . . . . 0.0 112.152 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.7 mttt . . . . . 0 N--CA 1.477 0.913 0 O-C-N 124.285 0.991 . . . . 0.0 110.778 179.96 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 40.9 t . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -71.63 -74.1 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.489 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -90.31 -61.29 1.71 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.245 0.341 . . . . 0.0 110.801 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -169.32 146.4 3.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.097 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -80.02 71.0 6.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.48 0.657 . . . . 0.0 111.127 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -88.26 -5.44 58.36 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.6 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -62.23 -51.13 68.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.73 0.3 . . . . 0.0 110.798 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -61.25 -34.13 74.65 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.67 -42.92 99.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.432 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.44 -38.74 92.3 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -63.59 -53.89 44.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.766 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -31.83 72.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.057 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -56.72 -56.11 25.56 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.02 0.438 . . . . 0.0 110.594 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -68.38 -44.58 74.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.588 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.35 -42.05 94.9 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.0 mt -65.01 -49.78 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.37 -25.13 61.69 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.17 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.02 -37.68 74.77 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.356 0.41 . . . . 0.0 111.98 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.9 mm? -69.93 119.9 74.44 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -89.01 -20.73 1.39 Allowed 'Trans proline' 0 N--CA 1.5 1.899 0 C-N-CA 123.208 2.605 . . . . 0.0 115.134 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 p30 -86.97 -2.57 58.72 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.403 HD23 ' OE1' ' A' ' 55' ' ' GLN . 39.8 mt -71.36 135.13 47.16 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.387 178.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -51.33 143.64 11.13 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.586 0.554 . . . . 0.0 110.095 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -47.97 -39.96 20.99 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.403 0.439 . . . . 0.0 112.152 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.65 -44.4 74.19 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.023 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.561 HE22 HD22 ' A' ' 51' ' ' LEU . 91.5 mt-30 -62.68 -36.95 84.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.111 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -57.55 -56.78 17.43 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.666 0.269 . . . . 0.0 110.973 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -68.71 -34.53 75.8 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.182 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.61 -52.41 63.89 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -59.45 -61.25 2.76 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 120.422 -0.511 . . . . 0.0 112.118 -178.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.7 -41.67 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.188 0.305 . . . . 0.0 111.657 -178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.0 ttt-85 -63.28 -49.28 74.68 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.924 0.392 . . . . 0.0 110.175 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 57.1 m -61.19 -30.22 70.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.024 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.14 -43.86 92.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.061 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -66.17 -41.95 89.6 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.011 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -43.11 88.41 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.876 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -135.94 74.51 57.03 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.018 0.437 . . . . 0.0 110.638 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -60.68 -11.03 15.75 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.486 2.124 . . . . 0.0 113.11 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.4 p -62.02 -25.08 67.45 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.83 16.81 19.4 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -48.56 -37.24 17.32 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.86 -45.23 90.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.425 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -64.3 -47.17 80.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.113 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.81 -41.86 78.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.408 0.443 . . . . 0.0 111.267 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.56 -49.99 75.34 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.03 99.74 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.764 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -59.92 -38.08 81.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.864 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -47.76 81.01 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -62.53 -37.78 87.43 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.336 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -60.2 -45.29 93.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.272 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.561 HD22 HE22 ' A' ' 26' ' ' GLN . 9.3 mt -64.87 -39.8 94.13 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -60.02 -49.1 79.0 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.429 0.456 . . . . 0.0 110.307 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.63 -38.87 89.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.265 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.51 -51.37 14.93 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.403 ' OE1' HD23 ' A' ' 22' ' ' LEU . 68.5 mt-30 -65.45 -27.94 68.87 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.614 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.34 145.0 59.96 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.288 0.367 . . . . 0.0 111.467 -179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.47 151.62 47.92 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.923 2.415 . . . . 0.0 112.261 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt . . . . . 0 C--O 1.223 -0.329 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.408 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.86 -79.78 0.05 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.265 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -89.73 -60.96 1.8 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.09 0.244 . . . . 0.0 110.636 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -172.11 146.36 1.92 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.102 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -81.33 51.77 1.69 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.458 0.647 . . . . 0.0 111.044 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -56.28 -29.23 60.89 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.562 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.0 -35.31 64.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.511 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.569 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -40.84 97.36 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.507 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -58.49 -41.29 84.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.457 0.473 . . . . 0.0 110.806 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -63.22 -54.97 29.07 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.146 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.55 78.24 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.291 -179.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -55.89 -53.01 61.94 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.904 0.383 . . . . 0.0 111.153 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.4 t90 -67.54 -46.38 72.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.219 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.41 -43.5 96.65 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.846 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 93.2 mt -64.74 -48.96 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -31.34 68.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.304 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.51 -35.96 77.2 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.295 0.372 . . . . 0.0 111.531 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -67.67 120.24 71.95 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -88.62 -26.92 0.49 Allowed 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 123.663 2.908 . . . . 0.0 116.297 -178.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -83.71 -0.66 51.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -176.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.0 mt -72.28 135.21 45.92 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.319 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -54.11 142.84 24.15 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.654 0.596 . . . . 0.0 110.234 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -47.6 -42.63 24.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -66.61 -41.47 88.34 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.287 0.367 . . . . 0.0 111.383 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.65 HE22 HD22 ' A' ' 51' ' ' LEU . 90.4 mt-30 -64.98 -41.36 95.51 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.063 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -52.99 -54.38 35.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.717 0.294 . . . . 0.0 111.172 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -71.43 -36.05 71.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.401 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.83 -55.37 36.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -60.25 -54.13 49.4 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.9 mt -58.22 -41.1 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.188 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -64.81 -48.03 75.88 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.04 0.447 . . . . 0.0 109.999 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.2 t -61.81 -24.99 67.22 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.361 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.14 -43.94 98.11 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.649 0.593 . . . . 0.0 109.52 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -67.18 -39.9 86.5 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -64.6 -30.63 71.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.339 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -144.74 76.62 13.96 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 120.771 0.319 . . . . 0.0 110.683 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -54.42 -31.41 68.27 Favored 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.987 2.458 . . . . 0.0 112.698 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -59.36 -28.45 66.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.203 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -92.74 1.88 57.04 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.2 t -44.02 -41.66 5.57 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.69 -46.0 76.99 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.667 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -67.18 -46.11 74.95 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.181 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -57.73 -43.45 85.34 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.159 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.7 tp -60.92 -49.87 75.72 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.38 97.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.804 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -62.57 -39.02 92.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.348 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -40.95 97.13 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -63.81 -36.38 83.71 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.586 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -59.81 -44.31 94.05 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.15 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.65 HD22 HE22 ' A' ' 26' ' ' GLN . 80.7 mt -62.54 -43.09 99.67 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.1 178.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.24 -48.38 81.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.29 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -61.76 -38.42 87.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.494 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.47 -51.55 11.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.8 -27.92 68.63 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 146.04 56.64 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.166 0.291 . . . . 0.0 111.485 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.82 153.76 58.77 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.997 2.465 . . . . 0.0 112.22 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mttp . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.484 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.466 HG22 ' N ' ' A' ' 2' ' ' ASP . 12.7 p . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.466 ' N ' HG22 ' A' ' 1' ' ' VAL . 18.0 t70 -63.5 148.7 47.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.097 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -54.67 -22.38 13.55 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.528 -179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -24.63 17.06 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.447 ' CD2' ' CE ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -63.91 -62.55 1.57 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.518 0.199 . . . . 0.0 111.529 -179.135 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -58.65 -36.43 74.12 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.71 -55.28 37.09 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.98 -43.19 99.47 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.362 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.667 ' SD ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -63.17 -44.72 94.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.967 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -57.68 -41.43 81.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.318 0.387 . . . . 0.0 111.05 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -61.01 -57.14 13.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.465 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -30.33 68.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.456 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CD2' HD13 ' A' ' 31' ' ' ILE . 42.0 t80 -56.37 -58.99 5.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.895 0.379 . . . . 0.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -65.74 -43.26 89.49 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.652 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -59.91 -50.75 72.56 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.186 0.303 . . . . 0.0 111.27 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 89.7 mt -63.57 -47.08 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 120.575 0.226 . . . . 0.0 110.484 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.41 -29.42 64.11 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.64 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -60.65 -36.98 80.04 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.241 0.338 . . . . 0.0 111.641 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.32 120.02 61.31 Favored Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -88.85 -26.18 0.55 Allowed 'Trans proline' 0 N--CA 1.503 2.038 0 C-N-CA 123.696 2.931 . . . . 0.0 116.28 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -84.62 -0.44 53.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.6 mt -72.84 135.65 45.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.579 178.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -53.89 143.52 21.15 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.698 0.624 . . . . 0.0 110.136 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -47.85 -40.74 22.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -68.8 -43.13 76.26 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.684 0.278 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.605 HE22 HD22 ' A' ' 51' ' ' LEU . 95.1 mt-30 -63.81 -37.73 88.48 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.273 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -56.36 -55.07 38.03 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.733 0.302 . . . . 0.0 111.279 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm180 -72.21 -31.9 66.27 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.494 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.1 -50.34 73.1 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.4 -55.41 31.8 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 13' ' ' TYR . 49.2 mt -56.79 -38.34 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 122.966 0.166 . . . . 0.0 111.31 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 mmm-85 -65.94 -42.29 90.24 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.5 t -61.89 -30.58 70.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.084 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.667 HD12 ' SD ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -53.51 -51.07 63.99 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.781 179.577 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.27 -39.51 94.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -56.98 -38.08 72.52 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.599 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.92 104.62 1.15 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 121.165 -0.214 . . . . 0.0 111.19 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.18 -17.39 59.54 Favored 'Trans proline' 0 N--CA 1.502 1.971 0 C-N-CA 121.898 1.732 . . . . 0.0 111.69 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.3 p -59.52 -30.71 68.77 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -96.39 1.14 51.49 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.124 0.265 . . . . 0.0 111.461 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.3 p -43.7 -51.82 6.88 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.54 91.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.744 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -69.11 -49.06 60.5 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.295 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.2 mt -56.72 -45.09 82.09 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.495 0.497 . . . . 0.0 110.923 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.99 -52.21 66.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.27 86.68 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.056 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -62.54 -37.72 87.22 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.261 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.64 95.65 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -63.54 -35.47 80.58 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.783 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -59.64 -47.14 86.77 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.342 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.605 HD22 HE22 ' A' ' 26' ' ' GLN . 13.9 mt -63.36 -39.74 95.36 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.335 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.3 -48.43 81.43 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.316 0.385 . . . . 0.0 110.114 178.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -62.4 -38.68 90.6 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.312 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.34 -51.56 12.88 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -66.35 -27.93 68.27 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.23 146.44 61.97 Favored Pre-proline 0 CA--C 1.537 0.466 0 O-C-N 123.206 0.316 . . . . 0.0 111.327 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.18 158.8 55.16 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.846 2.364 . . . . 0.0 111.989 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt . . . . . 0 CA--C 1.541 0.609 0 O-C-N 124.059 0.85 . . . . 0.0 110.923 -179.975 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 44.4 t . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -71.13 -72.32 0.22 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.56 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -90.42 -61.5 1.67 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.213 0.32 . . . . 0.0 111.075 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -171.25 149.43 2.8 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.185 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -82.88 52.3 2.12 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.523 0.678 . . . . 0.0 111.349 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -59.22 -30.8 68.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.312 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -55.32 -34.6 64.31 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.333 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.28 -44.22 97.59 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.361 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -38.73 92.22 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -59.21 -39.22 81.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.63 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -65.26 -55.24 19.54 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.057 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.8 -34.96 79.07 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.949 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -56.57 -52.95 62.88 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.214 0.531 . . . . 0.0 110.625 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -62.53 -46.01 90.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.775 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -61.09 -42.31 98.27 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -178.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.3 mt -62.34 -53.86 41.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 120.638 0.256 . . . . 0.0 110.421 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.83 -30.58 67.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.37 -37.14 79.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 123.242 0.339 . . . . 0.0 111.203 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.65 120.8 68.92 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.14 -21.6 1.57 Allowed 'Trans proline' 0 N--CA 1.504 2.134 0 C-N-CA 123.824 3.016 . . . . 0.0 116.236 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -89.85 -0.15 57.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -176.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.8 mt -74.89 138.37 42.39 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.85 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -60.94 145.93 48.65 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.834 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -51.38 -42.38 61.35 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.06 -37.95 81.86 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.221 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.441 HE22 HD22 ' A' ' 51' ' ' LEU . 92.3 mt-30 -67.32 -53.96 24.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 28' ' ' ARG . 1.5 ptpm? -56.34 -48.58 76.49 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.68 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.419 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 77.9 mtt85 -63.25 -33.44 75.51 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.763 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.66 -55.64 16.42 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -60.0 -41.2 91.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.146 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 mm -57.05 -42.3 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -72.55 -35.69 68.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.194 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -57.51 -33.66 68.29 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.508 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 34' ' ' LEU . 2.8 mm? -51.72 -53.6 37.58 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.168 0.292 . . . . 0.0 110.368 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.16 -39.69 95.39 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.051 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.26 -40.86 95.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.503 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -151.31 82.92 5.63 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 123.243 0.339 . . . . 0.0 110.332 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.76 -24.97 80.18 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.411 2.074 . . . . 0.0 112.13 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -59.6 -33.15 71.1 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.172 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -88.76 8.69 27.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.439 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.3 p -43.35 -48.74 6.97 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.94 95.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.696 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.35 -47.26 61.84 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.294 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -58.14 -43.97 87.6 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.314 0.384 . . . . 0.0 110.857 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.78 -49.08 78.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.14 -41.92 97.6 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.881 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -62.89 -37.69 87.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.824 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.27 90.75 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -63.17 -36.31 83.21 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.624 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -58.54 -43.7 89.36 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.352 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.441 HD22 HE22 ' A' ' 26' ' ' GLN . 75.6 mt -63.11 -41.98 99.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.988 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -62.68 -47.81 82.05 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.326 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -61.76 -37.86 85.85 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.348 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.78 -50.69 14.49 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -67.88 -27.46 66.68 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 158.48 5.58 Favored Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.19 155.8 11.36 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.151 2.567 . . . . 0.0 112.993 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.3 mptt . . . . . 0 CA--C 1.534 0.357 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.414 -179.871 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -67.58 -65.83 0.64 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.21 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -91.3 -60.55 1.86 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 mttp 179.65 158.11 0.66 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.265 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -84.97 43.63 1.01 Allowed 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.378 0.609 . . . . 0.0 111.301 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -63.62 -37.44 87.35 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.538 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -53.61 -49.48 67.74 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.077 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -61.97 -41.82 98.44 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.742 -179.6 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.411 ' SD ' ' HB3' ' A' ' 38' ' ' PRO . 73.7 mtm -64.26 -37.05 86.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.878 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -61.04 -39.8 91.19 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.852 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -61.75 -43.47 98.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.953 179.163 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.05 -40.13 87.05 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.259 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -48.93 76.94 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.566 179.908 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -61.37 -44.41 97.21 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -61.36 -39.93 92.45 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 82.0 mt -60.97 -52.77 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.279 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.31 -31.42 67.49 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.424 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.99 -35.76 77.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.573 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -70.26 121.71 84.05 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.495 -179.282 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -87.34 -22.81 1.59 Allowed 'Trans proline' 0 N--CA 1.507 2.268 0 C-N-CA 123.823 3.015 . . . . 0.0 115.259 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.95 79.98 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -177.645 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.692 HD12 ' H ' ' A' ' 22' ' ' LEU . 4.1 mp -73.01 132.31 43.23 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.977 0.417 . . . . 0.0 111.025 -178.714 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.36 156.98 3.97 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.101 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -57.07 -42.13 80.04 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.305 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -43.92 96.1 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.859 -179.391 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -62.99 -39.06 93.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.71 179.85 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -58.4 -64.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.935 -179.384 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -59.58 -34.22 72.44 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.721 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.24 -43.77 95.79 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.281 0.363 . . . . 0.0 111.53 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -63.54 -52.52 60.77 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.93 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.0 mm -56.41 -46.03 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.155 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -61.49 -47.79 84.03 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 120.679 0.276 . . . . 0.0 110.358 179.737 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.8 t -62.34 -30.46 71.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.246 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.18 -51.47 69.6 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.449 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -62.28 -40.52 96.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.678 179.086 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.77 -40.05 93.81 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.116 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -136.76 82.89 31.01 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.668 -179.357 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.411 ' HB3' ' SD ' ' A' ' 9' ' ' MET . 51.7 Cg_exo -53.49 -28.23 44.01 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.869 2.379 . . . . 0.0 112.424 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.5 -35.01 73.32 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.008 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -82.66 -1.47 51.21 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.091 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.0 p -41.31 -54.43 3.0 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.001 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.74 92.35 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -67.95 -50.22 57.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.745 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -57.05 -40.76 77.43 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 123.091 0.244 . . . . 0.0 111.15 -178.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.4 tp -61.49 -50.3 73.29 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.732 179.164 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.18 89.83 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.824 178.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -62.19 -36.5 82.1 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.58 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.58 -39.66 91.85 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -63.68 -39.65 94.84 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.609 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.83 -51.89 66.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.37 -36.3 83.57 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.458 ' HB2' HD11 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.96 -49.11 78.79 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.371 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -63.68 -37.03 85.79 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.729 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.7 -52.25 13.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -177.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -68.31 -25.88 65.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.52 149.45 39.79 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 123.06 0.225 . . . . 0.0 111.085 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.93 155.01 62.85 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 122.776 2.318 . . . . 0.0 112.272 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? . . . . . 0 N--CA 1.476 0.83 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.865 179.921 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.02 -40.12 72.95 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.44 -179.68 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.43 -41.78 90.34 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.666 0.269 . . . . 0.0 110.7 179.763 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 tttp -69.35 -51.75 33.89 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.945 179.455 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -24.69 67.72 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -91.74 -61.51 1.62 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.97 -47.42 83.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -57.96 -46.49 85.01 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 120.803 0.335 . . . . 0.0 111.115 -178.718 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -50.3 72.32 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.48 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -55.78 -41.55 74.22 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 123.569 0.543 . . . . 0.0 111.61 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -58.42 -61.89 2.25 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.501 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.29 -23.52 64.76 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.294 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -58.71 -58.93 6.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' TRP . . . . . 0.449 ' CD1' ' C ' ' A' ' 14' ' ' TRP . 0.4 OUTLIER -73.58 -35.45 65.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.515 -178.937 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.68 -47.46 85.55 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.198 0.311 . . . . 0.0 110.793 -179.286 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.427 HG23 ' HB1' ' A' ' 48' ' ' ALA . 96.7 mt -68.58 -49.92 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.832 179.451 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.0 -24.94 42.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.773 -178.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.1 tp -56.7 -39.03 73.12 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.359 0.412 . . . . 0.0 111.899 -179.044 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.477 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.1 mm? -68.73 120.89 78.83 Favored Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -89.19 -9.94 4.18 Favored 'Trans proline' 0 N--CA 1.504 2.119 0 C-N-CA 123.597 2.865 . . . . 0.0 115.671 -178.222 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.4 p30 -95.84 -1.43 49.53 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.439 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -75.25 130.36 38.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.69 178.759 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -53.89 148.12 10.96 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.628 0.58 . . . . 0.0 109.612 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -53.05 -44.0 67.07 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.47 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -65.54 -42.17 92.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.177 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.564 HE22 HD22 ' A' ' 51' ' ' LEU . 91.8 mt-30 -65.22 -48.2 74.18 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.303 -179.428 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -61.34 -49.13 78.2 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 123.303 0.377 . . . . 0.0 110.688 -179.631 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.74 -39.51 91.84 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.641 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.03 -44.44 95.92 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.156 -179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -60.31 -56.93 15.53 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.649 -179.145 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.1 mt -57.89 -44.19 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 123.162 0.289 . . . . 0.0 110.978 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.7 ttt-85 -62.17 -50.02 73.5 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.843 0.354 . . . . 0.0 110.616 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 t -58.15 -29.31 65.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -45.61 91.46 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -64.12 -39.74 94.68 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.368 178.686 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -59.81 -36.29 76.47 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.05 92.68 2.58 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.82 -179.843 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.98 -18.68 51.63 Favored 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.381 2.054 . . . . 0.0 111.901 179.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.1 p -59.43 -25.32 64.24 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.811 -179.459 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -102.26 0.87 35.07 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.3 m -46.1 -39.74 9.86 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.673 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.78 84.1 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -67.3 -48.05 68.78 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.28 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.1 mt -57.46 -43.01 83.65 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.233 0.333 . . . . 0.0 111.056 -179.155 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.0 -50.96 71.69 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.26 0.553 . . . . 0.0 109.687 179.083 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.0 -41.33 96.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.04 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -63.72 -38.12 89.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.776 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.427 ' HB1' HG23 ' A' ' 16' ' ' ILE . . . -63.62 -44.69 93.19 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -63.49 -32.96 74.55 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.05 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -60.27 -47.47 85.85 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.953 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.564 HD22 HE22 ' A' ' 26' ' ' GLN . 7.8 mt -63.82 -37.11 86.15 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.004 178.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.66 -48.77 77.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.988 178.928 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.52 -38.75 91.18 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.88 -51.58 15.74 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.161 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.5 -27.5 67.83 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.067 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.48 145.44 48.74 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 123.237 0.335 . . . . 0.0 111.588 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.28 154.71 41.41 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 123.084 2.523 . . . . 0.0 112.476 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.392 179.805 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -73.74 -74.52 0.18 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.386 -179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -89.93 -60.99 1.79 Allowed 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.255 0.347 . . . . 0.0 110.583 179.856 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -173.1 151.86 2.19 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -83.24 56.26 3.46 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 110.867 179.92 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -59.88 -28.12 67.27 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.629 179.747 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -55.16 -37.49 67.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.589 -178.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -62.95 -40.03 96.42 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.669 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -39.36 93.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.555 179.308 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -59.28 -43.59 92.51 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 123.378 0.424 . . . . 0.0 110.649 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -62.75 -50.83 69.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.268 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.05 78.34 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.139 -179.603 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -55.8 -55.82 27.87 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.969 0.414 . . . . 0.0 110.895 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -64.98 -45.66 84.73 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.442 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -58.61 -49.48 77.32 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.511 -178.515 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 85.6 mt -57.76 -50.17 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.662 0.268 . . . . 0.0 110.877 179.621 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.57 -25.42 64.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.935 -179.719 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -60.81 -38.28 84.86 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.238 0.336 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.51 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.4 mm? -66.58 121.11 75.72 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.016 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.75 -8.05 5.25 Favored 'Trans proline' 0 N--CA 1.503 2.031 0 C-N-CA 123.592 2.862 . . . . 0.0 115.587 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -98.97 -2.3 37.73 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.929 0.714 . . . . 0.0 112.929 -177.499 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.98 130.9 39.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.451 178.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -52.28 145.61 10.65 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.199 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -50.79 -41.0 56.74 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.806 -178.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.59 -42.11 83.03 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.926 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.66 HE22 HD22 ' A' ' 51' ' ' LEU . 90.2 mt-30 -62.31 -42.18 99.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.697 -179.053 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm -55.42 -63.8 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.632 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -58.21 -32.24 68.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.247 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.77 -62.31 1.89 Allowed 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.174 0.297 . . . . 0.0 111.209 -179.068 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -61.55 -40.29 94.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.086 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.4 -39.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.291 179.025 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -75.1 -39.31 60.79 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.571 178.797 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.3 m -55.0 -35.45 64.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.544 -179.258 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.33 -43.98 71.7 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.248 0.342 . . . . 0.0 110.527 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -68.43 -41.01 80.97 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.173 178.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.22 -41.89 94.03 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.098 -178.951 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.17 85.21 6.98 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 120.862 0.363 . . . . 0.0 111.098 -179.349 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -54.83 -23.73 35.23 Favored 'Trans proline' 0 N--CA 1.502 1.988 0 C-N-CA 122.908 2.405 . . . . 0.0 112.755 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.7 p -61.91 -27.76 69.04 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.809 -179.284 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -96.13 8.01 44.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -178.666 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m -44.78 -40.87 6.45 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -178.789 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -45.39 75.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.788 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -67.52 -48.29 67.47 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.705 -179.178 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -57.33 -45.53 84.17 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.225 0.328 . . . . 0.0 111.291 -178.75 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.2 tp -60.1 -49.34 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.34 -40.5 94.49 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.817 178.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -64.17 -38.98 92.99 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 179.33 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.55 -46.55 82.32 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.558 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -63.27 -32.2 73.54 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.046 179.306 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.2 -44.44 95.11 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.897 179.112 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.66 HD22 HE22 ' A' ' 26' ' ' GLN . 45.7 mt -63.21 -39.42 94.57 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.906 178.607 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -62.98 -49.14 75.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.247 178.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.42 -38.61 90.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.256 -179.58 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.52 -51.62 14.19 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.031 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -66.2 -27.34 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.132 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 145.33 60.13 Favored Pre-proline 0 CA--C 1.539 0.524 0 O-C-N 123.227 0.329 . . . . 0.0 111.266 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -74.74 153.45 43.14 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 122.895 2.396 . . . . 0.0 112.42 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.44 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -61.68 -40.01 93.44 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.406 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 12.6 mtt -66.0 -39.56 90.38 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.753 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -58.01 -45.1 87.44 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.502 0.501 . . . . 0.0 110.742 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.43 -51.31 68.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.91 68.26 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.109 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.98 -64.89 0.78 Allowed 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.796 0.331 . . . . 0.0 110.769 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -71.06 -36.23 72.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.91 -40.73 81.09 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.995 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.67 -44.73 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.89 64.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.157 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.15 -37.63 80.69 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.938 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.505 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.5 mm? -66.02 120.87 72.86 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 120.32 -0.552 . . . . 0.0 109.877 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.37 -7.89 5.66 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.665 2.91 . . . . 0.0 115.78 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -99.18 -2.17 37.46 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.491 ' HA ' HE22 ' A' ' 55' ' ' GLN . 32.4 mt -74.51 133.26 42.32 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.314 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.555 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -53.09 146.8 10.68 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.067 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -51.96 -40.7 61.28 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -68.24 -42.51 79.61 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.95 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.555 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.17 -43.37 95.35 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.716 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -57.15 -48.0 79.77 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.54 0.21 . . . . 0.0 111.16 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.31 -35.85 68.74 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.62 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.14 -56.77 17.91 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -59.95 -45.81 91.43 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.796 -0.361 . . . . 0.0 111.947 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.8 mt -58.6 -38.66 72.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.664 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -74.24 -32.53 63.01 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -58.23 -33.22 69.11 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.842 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -52.64 -50.27 63.5 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -63.27 -39.19 93.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.112 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.28 -38.28 79.77 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.701 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.46 84.53 2.55 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 120.859 0.361 . . . . 0.0 110.728 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.07 -25.22 44.1 Favored 'Trans proline' 0 N--CA 1.502 1.976 0 C-N-CA 122.834 2.356 . . . . 0.0 112.631 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.6 p -60.41 -30.91 69.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.556 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -92.08 8.83 36.0 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.171 0.295 . . . . 0.0 111.767 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.0 p -43.65 -50.86 7.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.45 92.95 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.322 0.389 . . . . 0.0 110.895 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -70.37 -49.62 47.31 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -57.0 -44.82 83.17 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.319 0.387 . . . . 0.0 111.054 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.9 tp -60.2 -48.64 80.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.96 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.81 -43.37 98.99 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -61.22 -38.89 88.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.939 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.92 88.4 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -63.1 -32.42 73.79 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.943 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -60.77 -43.66 97.75 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.84 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.82 -39.67 95.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.802 178.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.475 ' ND2' HD12 ' A' ' 19' ' ' LEU . 16.2 t-20 -63.42 -49.83 72.21 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.093 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.56 -38.57 90.57 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.21 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -51.55 15.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.491 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.9 mt-30 -65.83 -27.27 68.12 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.28 145.33 57.74 Favored Pre-proline 0 CA--C 1.54 0.558 0 O-C-N 123.144 0.278 . . . . 0.0 111.277 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.39 170.03 5.83 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.515 2.144 . . . . 0.0 111.805 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 CA--C 1.547 0.864 0 CA-C-O 117.565 -1.207 . . . . 0.0 110.606 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 111.359 0.133 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.91 -40.52 96.67 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 121.09 -0.244 . . . . 0.0 110.655 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtm -62.14 -46.14 90.31 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.284 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -58.11 -39.72 79.35 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.507 0.505 . . . . 0.0 110.986 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -60.53 -57.56 12.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.153 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.35 68.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 31' ' ' ILE . 40.1 t80 -55.24 -58.77 6.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.202 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -71.09 -38.77 72.39 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -60.18 -43.13 96.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.962 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 87.7 mt -65.19 -47.53 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -30.85 68.2 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -59.51 -35.95 75.13 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.531 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mp -67.06 120.34 71.24 Favored Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -88.38 -26.23 0.64 Allowed 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.752 2.968 . . . . 0.0 116.247 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -84.66 -0.22 52.68 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.511 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.4 mt -73.5 132.91 43.42 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.525 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.539 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -50.62 145.49 6.68 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.815 0.697 . . . . 0.0 109.781 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -50.49 -40.3 50.69 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.36 -41.43 85.11 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.686 0.279 . . . . 0.0 111.004 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.539 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -65.23 -39.56 92.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.933 -179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -55.3 -53.75 52.21 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.646 0.26 . . . . 0.0 111.459 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -72.69 -34.03 66.9 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.432 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.68 -59.62 5.09 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -59.0 -47.04 86.62 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.413 HG23 ' CD2' ' A' ' 13' ' ' TYR . 57.1 mt -59.78 -37.32 70.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.214 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -69.72 -37.89 76.71 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.7 m -58.94 -32.86 69.98 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.613 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 34' ' ' LEU . 1.9 mm? -51.22 -56.59 12.08 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 120.788 0.328 . . . . 0.0 110.299 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -62.68 -38.62 91.08 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.179 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.96 -36.54 72.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.993 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -161.98 82.9 1.75 Allowed Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 120.647 0.261 . . . . 0.0 111.106 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -56.81 -19.16 30.1 Favored 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.81 2.34 . . . . 0.0 112.919 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 t -57.42 -34.5 68.99 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.095 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -104.86 18.08 22.97 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.105 0.253 . . . . 0.0 111.071 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.8 p -50.82 -39.01 52.13 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -38.98 92.8 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.1 0.476 . . . . 0.0 109.934 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -68.59 -46.31 69.7 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.135 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.9 mt -57.35 -45.71 84.07 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.352 0.408 . . . . 0.0 111.289 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 tp -60.49 -49.38 77.8 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.58 95.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.823 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -64.05 -39.59 94.42 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.654 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.05 95.42 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -64.85 -37.46 87.69 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.398 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -59.6 -43.25 93.77 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.219 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.1 mt -63.18 -43.06 99.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.949 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -61.51 -48.24 81.96 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.261 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.35 -38.4 86.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.506 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.53 -51.52 11.54 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.511 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.0 mt-30 -66.3 -27.86 68.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.93 144.81 56.41 Favored Pre-proline 0 CA--C 1.539 0.529 0 O-C-N 123.157 0.286 . . . . 0.0 111.593 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.31 153.58 50.84 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 122.982 2.454 . . . . 0.0 112.326 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.418 179.817 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.66 -34.34 72.7 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.1 0.476 . . . . 0.0 109.989 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -43.64 97.14 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.949 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.98 -39.23 88.83 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.979 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -61.46 -55.94 25.63 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.846 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.65 74.26 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -55.69 -59.72 4.45 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.622 0.248 . . . . 0.0 111.34 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -71.08 -38.09 72.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.166 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.23 -41.65 89.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.802 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.76 -48.97 80.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.73 -30.6 67.6 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.0 tp -60.33 -36.27 77.56 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.663 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -64.42 120.69 67.35 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -87.83 -27.72 0.52 Allowed 'Trans proline' 0 N--CA 1.504 2.107 0 C-N-CA 123.765 2.977 . . . . 0.0 116.271 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -83.89 -0.5 51.55 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.507 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -72.94 135.98 45.11 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.373 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.542 ' H ' HE21 ' A' ' 26' ' ' GLN . 81.2 m-20 -55.11 144.94 22.25 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.537 0.523 . . . . 0.0 109.973 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -49.66 -41.51 43.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -66.16 -41.42 90.37 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.149 0.281 . . . . 0.0 110.912 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.542 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.7 mt-30 -65.44 -40.3 93.1 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.047 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -55.69 -53.18 59.68 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.738 0.304 . . . . 0.0 111.235 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -70.41 -36.78 74.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.204 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.93 -58.37 8.83 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -58.64 -47.05 85.73 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -61.04 -37.95 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.431 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.6 ttt-85 -68.51 -41.86 79.39 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.4 m -58.97 -34.52 71.9 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.995 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.408 ' HG ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -55.89 -44.27 78.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.254 0.346 . . . . 0.0 110.543 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -66.94 -42.67 84.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.117 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.95 -39.54 90.54 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.033 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -137.09 77.27 43.23 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.179 0.3 . . . . 0.0 110.465 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.17 -24.27 78.81 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.355 2.036 . . . . 0.0 112.266 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.7 p -61.76 -30.53 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.332 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -90.68 5.27 48.79 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 123.27 0.356 . . . . 0.0 110.905 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 p -40.15 -53.96 2.38 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.87 92.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.277 0.361 . . . . 0.0 110.972 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -67.76 -47.11 70.14 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.184 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.408 HD12 ' HG ' ' A' ' 34' ' ' LEU . 91.7 mt -58.44 -40.84 83.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.258 0.349 . . . . 0.0 111.046 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.2 tp -61.76 -48.09 82.25 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.07 -43.12 99.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.704 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -62.21 -38.98 91.23 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.682 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.28 96.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -63.45 -36.65 84.46 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.555 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -59.2 -43.89 92.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.377 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.91 -43.81 97.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.029 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.35 -47.99 83.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -61.78 -38.35 87.73 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.533 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.43 -50.93 12.87 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.507 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.9 mt-30 -66.02 -27.85 68.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.18 144.82 58.9 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.192 0.308 . . . . 0.0 111.64 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.2 167.98 8.4 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 122.649 2.233 . . . . 0.0 112.021 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 CA--C 1.547 0.843 0 CA-C-O 117.436 -1.269 . . . . 0.0 110.762 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.2 tptt . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -62.32 -37.54 85.97 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.469 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.54 -41.76 98.44 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.372 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.89 -39.1 87.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.418 0.449 . . . . 0.0 110.35 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -59.81 -54.84 41.54 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.772 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.9 70.36 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.167 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -54.76 -57.84 9.93 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.692 0.282 . . . . 0.0 111.232 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -69.24 -39.9 78.23 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.83 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -60.92 -40.5 93.4 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.122 0.263 . . . . 0.0 111.111 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 71.6 mt -64.7 -52.08 59.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.33 -29.07 68.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.393 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.18 -32.88 71.49 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.473 0.483 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.0 OUTLIER -56.34 136.82 75.73 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.186 -178.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -90.47 -42.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 123.597 2.864 . . . . 0.0 116.592 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.86 -0.48 57.59 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.511 ' HA ' HE22 ' A' ' 55' ' ' GLN . 95.9 mt -65.48 137.82 57.69 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.672 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.624 ' H ' HE21 ' A' ' 26' ' ' GLN . 65.2 t30 -57.64 157.79 6.76 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -53.01 -51.28 62.17 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.12 -41.02 74.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.624 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.6 mt-30 -59.41 -42.47 91.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -59.78 -50.58 73.27 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.062 0.226 . . . . 0.0 111.003 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 -71.8 -32.08 67.24 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.414 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.02 -47.08 87.32 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -59.64 -53.11 61.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.89 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.0 mt -59.01 -39.87 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 122.977 0.173 . . . . 0.0 110.582 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.4 -43.95 92.79 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 120.968 0.413 . . . . 0.0 109.973 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.4 m -60.67 -32.68 71.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.82 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -46.97 76.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.097 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -64.59 -42.45 95.58 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.482 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.16 -36.9 81.05 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.49 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -151.51 88.41 4.32 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.587 0.232 . . . . 0.0 111.159 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -54.33 -24.92 36.74 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.755 2.303 . . . . 0.0 112.517 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -58.9 -33.6 70.72 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.449 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -86.35 1.23 51.91 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.7 p -40.03 -56.23 1.9 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.78 92.52 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.48 -47.47 66.99 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.594 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 36.8 mt -57.98 -41.5 83.12 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.408 0.443 . . . . 0.0 110.859 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.59 -50.76 71.32 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.89 83.22 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.023 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -61.76 -33.36 73.94 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.596 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -43.79 91.35 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -62.5 -36.41 82.44 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.197 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -63.35 -50.6 69.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.69 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.88 -41.98 99.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.463 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.627 ' HB2' HD13 ' A' ' 19' ' ' LEU . 8.0 t-20 -60.65 -47.47 86.1 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.216 0.322 . . . . 0.0 110.389 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.95 -38.52 91.38 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.114 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.44 -51.42 13.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.511 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.9 mt-30 -66.0 -27.99 68.54 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.77 146.46 66.49 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 123.133 0.271 . . . . 0.0 111.131 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.74 159.93 50.52 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.881 2.387 . . . . 0.0 112.047 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.471 0.624 0 O-C-N 124.018 0.824 . . . . 0.0 110.932 -179.922 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp . . . . . 0 C--O 1.237 0.441 0 CA-C-O 121.074 0.464 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -63.55 -35.95 82.18 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.123 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.2 mtt -61.69 -40.82 96.36 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.854 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -62.08 -42.65 99.43 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.395 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -59.66 -50.93 71.97 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.731 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.42 -29.71 67.5 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.002 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE2' HD13 ' A' ' 31' ' ' ILE . 55.9 t80 -56.9 -55.02 39.93 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.518 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -75.3 -36.19 61.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.86 -47.51 83.06 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.94 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.96 -50.39 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.267 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -30.66 64.89 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.543 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -60.13 -36.76 78.22 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.402 0.439 . . . . 0.0 111.822 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.32 119.9 57.15 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -87.71 -22.18 1.6 Allowed 'Trans proline' 0 N--CA 1.503 2.063 0 C-N-CA 123.569 2.846 . . . . 0.0 115.516 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.529 HD21 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -82.62 -6.1 59.17 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.527 ' HA ' HE22 ' A' ' 55' ' ' GLN . 18.9 mt -72.99 131.53 42.27 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.662 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.578 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.5 t-20 -53.2 146.83 10.97 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.965 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -51.76 -41.44 61.61 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.0 -41.93 81.51 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.12 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.578 HE21 ' H ' ' A' ' 23' ' ' ASN . 29.6 mt-30 -63.17 -40.29 97.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.988 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -59.45 -57.72 11.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.762 0.315 . . . . 0.0 110.611 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -62.09 -33.82 75.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.831 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.84 95.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.869 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -60.71 -59.51 5.27 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.447 HD13 ' CE2' ' A' ' 13' ' ' TYR . 71.7 mt -56.4 -44.58 80.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 123.323 0.39 . . . . 0.0 111.293 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -62.01 -49.2 76.98 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.646 0.26 . . . . 0.0 110.759 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -63.7 -26.45 68.66 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.414 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -47.27 86.32 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.511 0.507 . . . . 0.0 109.759 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.96 -42.81 97.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.875 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.6 -36.69 85.04 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.523 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -137.73 78.64 36.25 Favored Pre-proline 0 CA--C 1.541 0.597 0 O-C-N 123.333 0.396 . . . . 0.0 110.567 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.42 -19.87 66.12 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.406 2.071 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.8 m -61.39 -29.89 70.21 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.055 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -99.2 3.91 46.55 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.2 m -44.1 -40.47 4.94 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -47.11 72.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 110.26 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -63.52 -43.81 96.08 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.894 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -57.95 -40.89 81.64 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.187 0.305 . . . . 0.0 111.015 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.25 -45.88 92.67 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.63 94.73 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.568 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -61.32 -37.96 85.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.878 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.5 94.93 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -62.74 -35.52 80.05 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.744 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.06 -46.87 88.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.569 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.6 mt -63.33 -39.3 94.17 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.529 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -62.56 -48.84 77.73 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.014 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.06 -38.39 88.62 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.095 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.4 -51.13 18.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.938 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.527 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.2 mt-30 -65.96 -27.04 67.86 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.753 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 148.52 29.73 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.126 0.266 . . . . 0.0 111.46 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.42 158.12 58.97 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.787 2.325 . . . . 0.0 112.045 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.02 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm . . . . . 0 N--CA 1.471 0.617 0 CA-C-O 120.507 0.194 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -61.68 -38.81 89.17 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.906 0.384 . . . . 0.0 110.26 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.75 -41.07 98.07 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.463 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -60.45 -38.95 85.81 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.33 0.394 . . . . 0.0 110.549 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -62.39 -51.36 67.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.658 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.11 -32.17 71.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.857 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -55.01 -61.48 2.28 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.004 0.43 . . . . 0.0 110.928 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.1 t90 -69.69 -42.01 74.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.686 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -57.93 -45.29 86.78 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.169 0.293 . . . . 0.0 111.282 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.2 -43.89 95.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.19 -28.84 67.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.2 tp -60.78 -36.37 78.8 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 123.357 0.411 . . . . 0.0 111.199 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.26 120.39 61.37 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -88.27 -20.35 1.77 Allowed 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 123.786 2.99 . . . . 0.0 116.289 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.3 p30 -91.42 -0.47 57.64 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' HA ' HE22 ' A' ' 55' ' ' GLN . 14.8 mt -71.53 137.62 48.25 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.414 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.583 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.0 t30 -57.14 148.63 21.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.031 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -52.55 -38.5 59.97 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.168 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -73.28 -39.45 65.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.33 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.583 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.1 mt-30 -66.28 -45.59 79.95 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -59.09 -43.01 91.8 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -72.37 -40.72 67.07 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.751 0.31 . . . . 0.0 110.764 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.8 97.73 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.243 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -61.8 -54.31 43.97 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.5 mt -60.77 -31.93 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -72.28 -42.76 65.18 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.055 0.455 . . . . 0.0 110.174 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.6 p -62.29 -26.08 68.21 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.438 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.418 HD22 HD13 ' A' ' 44' ' ' LEU . 1.4 mm? -53.51 -46.14 69.99 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 178.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.1 -39.75 71.91 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.152 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.79 -42.9 90.15 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.46 0.475 . . . . 0.0 111.963 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 82.59 9.23 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-O 120.872 0.368 . . . . 0.0 110.924 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -56.16 -20.15 30.03 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 122.856 2.371 . . . . 0.0 112.339 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.7 p -63.49 -27.7 69.46 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.735 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -99.58 5.11 46.04 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -43.49 -43.95 5.7 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.15 -46.24 81.68 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.879 0.371 . . . . 0.0 110.516 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.62 -43.93 92.15 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.323 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.418 HD13 HD22 ' A' ' 34' ' ' LEU . 82.9 mt -58.39 -42.74 87.75 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.277 0.36 . . . . 0.0 111.028 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.4 tp -60.51 -50.83 71.97 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.46 96.67 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -62.04 -36.49 81.76 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.442 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.69 98.78 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -64.12 -36.09 82.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.685 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -59.83 -44.76 93.88 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.227 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 51' ' ' LEU . 85.4 mt -60.7 -44.83 96.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.931 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -60.66 -48.56 81.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.544 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.06 -38.42 86.12 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.417 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.03 -51.49 12.22 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.502 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.0 mt-30 -65.48 -27.85 68.79 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.24 145.81 54.93 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 123.155 0.284 . . . . 0.0 111.435 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.98 164.65 26.55 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.862 2.375 . . . . 0.0 111.791 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.398 -0.811 . . . . 0.0 111.112 179.874 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.44 -38.6 87.75 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.576 0.227 . . . . 0.0 111.478 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.0 ttm -61.51 -54.49 42.56 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.273 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.06 -39.1 71.55 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.265 0.353 . . . . 0.0 111.718 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -58.64 -62.77 1.62 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 121.097 -0.241 . . . . 0.0 111.192 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.19 -27.25 67.11 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.73 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -56.53 -59.81 4.44 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.603 0.24 . . . . 0.0 111.07 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -70.58 -39.18 74.02 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.85 -41.49 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.277 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -68.61 -48.78 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.75 -29.38 66.7 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.267 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.57 -36.81 76.94 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.345 0.403 . . . . 0.0 111.332 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.13 121.71 73.39 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -87.6 -21.84 1.72 Allowed 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.57 2.847 . . . . 0.0 116.186 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -91.91 -1.09 57.47 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.495 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.1 mt -70.28 137.09 50.44 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.398 178.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.525 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.6 t-20 -58.64 145.66 39.01 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.38 -40.35 68.09 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -65.7 -45.28 83.39 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.481 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.525 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -63.62 -35.95 82.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.58 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -61.32 -61.76 2.32 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.538 0.524 . . . . 0.0 110.004 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -60.05 -38.18 82.03 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.15 87.65 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -61.58 -60.82 3.11 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.172 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -56.06 -40.06 61.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 123.351 0.407 . . . . 0.0 111.637 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -62.33 -49.84 74.01 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 m -62.36 -32.69 73.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.815 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.72 -44.79 90.53 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.076 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -63.43 -42.75 98.69 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.694 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.72 -36.96 82.46 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.211 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -147.65 86.39 6.29 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.167 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -60.95 -14.82 34.94 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 122.397 2.065 . . . . 0.0 112.253 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 t -57.81 -32.07 67.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.211 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -92.79 2.36 56.79 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.194 0.309 . . . . 0.0 111.415 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 60.7 p -44.32 -49.85 9.3 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.9 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -69.97 -48.8 56.83 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.127 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -58.28 -41.99 85.55 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.206 0.316 . . . . 0.0 110.905 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.4 -48.51 80.91 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.95 -41.18 97.68 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.674 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.14 -39.96 95.14 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.549 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.51 87.64 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -64.07 -38.21 90.25 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -62.58 -43.59 98.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.111 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.16 -47.26 85.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.485 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.4 -48.76 80.4 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.299 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.13 -38.6 83.54 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.067 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -51.28 15.54 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.967 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.495 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.18 -27.91 68.36 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.901 -179.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.37 144.77 50.72 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.259 0.349 . . . . 0.0 111.735 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.96 154.88 42.99 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 123.141 2.561 . . . . 0.0 112.356 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 118.121 -0.942 . . . . 0.0 110.543 179.719 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.1 tptm . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.6 -41.57 98.32 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.437 ' SD ' HD12 ' A' ' 34' ' ' LEU . 3.5 tpp -61.08 -48.61 80.92 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.892 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -58.21 -39.92 80.28 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.452 0.47 . . . . 0.0 111.214 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -59.58 -59.59 5.19 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.576 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.29 69.29 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.433 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -54.83 -61.2 2.46 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.867 0.365 . . . . 0.0 111.314 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.3 t90 -66.87 -41.96 86.42 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.781 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -59.67 -43.7 93.86 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.211 0.319 . . . . 0.0 111.352 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.27 -47.7 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.35 -26.36 64.98 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.309 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.24 -32.91 70.4 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 123.436 0.46 . . . . 0.0 111.74 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.1 mt -57.34 138.45 80.88 Favored Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.816 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -90.13 -43.97 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 123.518 2.812 . . . . 0.0 116.516 -176.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -86.8 -2.69 58.77 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -175.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.505 HD11 HD12 ' A' ' 19' ' ' LEU . 89.8 mt -66.9 132.25 47.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.294 -0.962 . . . . 0.0 109.143 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.596 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 6.0 m120 -57.0 158.28 5.07 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -56.32 -41.21 75.65 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.797 0.332 . . . . 0.0 111.044 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.69 -41.46 71.95 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.761 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.596 ' NE2' ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -61.22 -42.58 98.85 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.047 -179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.04 -54.41 45.2 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.105 0.478 . . . . 0.0 110.165 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -61.58 -34.69 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.9 71.63 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -60.12 -53.3 59.39 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.471 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.78 -34.06 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.837 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -64.37 -44.48 91.26 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 t -61.5 -31.53 71.53 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.174 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -53.39 -52.07 60.51 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.201 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.6 -39.4 93.63 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.197 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -58.38 -38.62 77.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.999 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.91 105.35 0.72 Allowed Pre-proline 0 CA--C 1.542 0.673 0 O-C-N 123.138 0.274 . . . . 0.0 111.062 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.36 -16.77 56.63 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.836 1.691 . . . . 0.0 111.067 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.2 m -57.57 -33.26 67.97 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.995 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -92.88 -3.05 55.28 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 123.192 0.308 . . . . 0.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.6 t -46.01 -38.04 7.34 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.69 73.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -67.88 -47.86 67.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.157 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.439 HD12 HD22 ' A' ' 34' ' ' LEU . 53.3 mt -56.12 -43.73 78.44 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.335 0.397 . . . . 0.0 111.018 -178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.8 tp -61.52 -50.8 71.23 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.04 84.74 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.94 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -62.59 -35.64 80.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.049 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -43.89 97.76 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -62.91 -38.42 90.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.08 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -62.23 -45.09 94.87 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.112 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -44.93 95.35 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.724 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.594 ' HB2' HD13 ' A' ' 19' ' ' LEU . 2.3 t-20 -59.17 -47.05 86.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.333 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.86 -36.79 82.28 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -52.0 27.6 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.278 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.468 ' NE2' HE22 ' A' ' 26' ' ' GLN . 26.9 mt-30 -72.04 -27.41 62.68 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.69 145.12 63.01 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.104 0.252 . . . . 0.0 111.474 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.6 170.0 4.87 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.694 2.263 . . . . 0.0 112.007 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp . . . . . 0 CA--C 1.548 0.882 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.673 179.801 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -58.32 -38.37 76.99 Favored 'General case' 0 C--O 1.237 0.433 0 O-C-N 123.25 0.344 . . . . 0.0 110.949 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -50.44 67.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.476 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -60.26 -37.04 79.2 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.349 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.6 -60.96 2.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.74 -31.63 72.94 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.288 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -56.01 -60.16 3.88 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.882 0.372 . . . . 0.0 111.038 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -68.76 -42.04 78.02 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.706 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -57.63 -46.85 83.62 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.281 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.5 mt -64.18 -45.98 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.65 -25.23 62.53 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.392 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.17 -37.34 74.53 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.762 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.455 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.2 mm? -72.65 120.24 79.6 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.208 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -89.04 -20.93 1.35 Allowed 'Trans proline' 0 N--CA 1.502 2.019 0 C-N-CA 123.666 2.91 . . . . 0.0 115.523 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.2 p30 -83.78 -2.57 56.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.51 ' HA ' HE22 ' A' ' 55' ' ' GLN . 58.2 mt -73.09 130.4 40.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.516 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.578 ' H ' HE21 ' A' ' 26' ' ' GLN . 44.7 t30 -49.89 147.11 4.04 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.815 0.697 . . . . 0.0 110.526 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -47.72 -43.15 26.69 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -68.9 -44.5 73.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.647 0.261 . . . . 0.0 110.938 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.578 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.7 mt-30 -59.88 -38.23 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.186 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -58.01 -56.05 27.07 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -71.64 -31.95 67.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.775 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.19 66.77 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -61.84 -54.25 44.71 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.0 mt -58.85 -43.05 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 123.041 0.213 . . . . 0.0 111.142 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.61 -45.81 92.5 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.908 0.385 . . . . 0.0 110.145 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 m -60.88 -31.65 71.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.553 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -47.44 83.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.425 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.11 -42.01 99.48 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.75 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.31 -35.2 78.31 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.338 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -144.59 83.64 9.61 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 123.126 0.266 . . . . 0.0 110.739 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.99 -24.6 49.43 Favored 'Trans proline' 0 N--CA 1.5 1.91 0 C-N-CA 122.652 2.235 . . . . 0.0 112.508 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -59.67 -30.67 68.93 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.751 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -96.34 5.09 51.68 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -45.41 -38.57 6.13 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.77 73.48 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.806 0.336 . . . . 0.0 110.619 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -67.14 -48.72 67.2 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.482 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.83 -42.65 80.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.172 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.77 -48.97 79.4 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.01 96.98 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.898 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -64.4 -39.76 94.49 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.863 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.19 90.75 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -63.21 -32.86 74.37 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.977 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.19 -46.54 89.39 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.189 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.2 mt -64.45 -38.0 89.49 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.157 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -60.93 -48.5 81.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.872 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.31 -37.58 88.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.147 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.42 -52.3 23.28 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.412 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.51 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.4 mt-30 -70.17 -27.64 64.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.271 -178.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.86 5.27 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 123.272 0.358 . . . . 0.0 111.718 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.42 156.96 9.99 Favored 'Trans proline' 0 N--CA 1.503 2.048 0 C-N-CA 123.15 2.566 . . . . 0.0 113.13 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.1 mmtp . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.414 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.2 mttt . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.56 -38.1 80.21 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.126 0.266 . . . . 0.0 111.704 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.6 ttm -61.0 -52.49 64.8 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.142 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -59.32 -36.41 75.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 123.273 0.358 . . . . 0.0 111.799 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -60.33 -60.94 3.02 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.116 0.26 . . . . 0.0 111.375 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.83 -28.18 66.5 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.463 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -56.39 -61.61 2.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.886 0.374 . . . . 0.0 111.085 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -67.45 -42.03 83.73 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.187 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -60.2 -46.22 90.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.118 0.261 . . . . 0.0 111.569 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.45 -48.33 85.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 121.061 -0.255 . . . . 0.0 110.372 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.8 65.59 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.424 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.3 tp -58.7 -35.93 73.43 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.447 0.467 . . . . 0.0 111.608 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.79 120.85 64.07 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -87.89 -22.08 1.56 Allowed 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 123.721 2.948 . . . . 0.0 116.403 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.403 HD21 ' ND2' ' A' ' 52' ' ' ASN . 46.4 p-10 -89.37 -0.69 57.67 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -177.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.517 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.3 mt -72.95 138.86 46.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.692 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.59 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.9 t-20 -58.25 144.07 42.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.331 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -49.67 -42.69 46.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -68.09 -41.08 82.42 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.095 0.247 . . . . 0.0 111.309 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.59 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.9 mt-30 -63.2 -38.05 89.65 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.157 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -59.17 -60.94 3.06 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 -62.16 -33.5 74.62 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.117 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.983 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -60.17 -61.48 2.58 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.657 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.455 HD13 ' CD2' ' A' ' 13' ' ' TYR . 54.2 mt -53.44 -43.16 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -61.25 -46.86 88.64 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.206 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.7 m -63.88 -33.7 76.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.61 -44.06 96.74 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.707 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -61.62 -40.72 95.84 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.617 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.66 -37.38 83.84 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.848 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.65 96.6 2.97 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.139 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.69 -16.34 52.34 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.089 1.859 . . . . 0.0 111.395 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.4 m -58.1 -32.63 68.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.822 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -89.12 -3.63 58.58 Favored 'General case' 0 C--O 1.225 -0.184 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.217 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 t -46.96 -39.52 12.55 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.26 -45.13 85.8 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.06 -48.07 66.61 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.285 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.9 mt -58.93 -42.69 90.36 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.234 0.334 . . . . 0.0 110.949 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.18 -48.65 80.85 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.057 0.456 . . . . 0.0 109.816 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.0 -43.4 98.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.7 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -61.08 -36.78 80.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.907 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.64 -44.43 90.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -61.9 -35.27 77.86 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.783 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -60.5 -45.47 93.66 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.097 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -65.38 -40.74 93.87 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.025 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.403 ' ND2' HD21 ' A' ' 21' ' ' ASN . 14.2 t-20 -60.59 -48.68 80.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.342 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.63 -38.58 90.81 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.397 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.96 -51.44 13.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.517 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.1 mt-30 -66.43 -27.43 67.83 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.895 -178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.43 142.97 48.79 Favored Pre-proline 0 N--CA 1.47 0.566 0 CA-C-O 120.846 0.355 . . . . 0.0 111.874 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.92 169.36 7.47 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.44 2.093 . . . . 0.0 112.013 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.645 179.207 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm . . . . . 0 C--O 1.241 0.644 0 CA-C-O 120.945 0.403 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -62.35 -35.27 78.58 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.149 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 58.2 mtt -62.21 -40.65 96.82 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -62.33 -41.83 98.89 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.72 -50.28 71.71 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.035 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.73 -34.93 77.82 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.04 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -55.48 -51.89 65.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.973 0.416 . . . . 0.0 110.802 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -66.04 -45.7 80.47 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.498 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -60.18 -40.7 90.93 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.743 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.68 -55.34 23.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.06 -31.44 65.21 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.458 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -61.71 -37.42 84.09 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.355 0.41 . . . . 0.0 111.153 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -67.58 121.21 78.18 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -87.2 -34.43 0.13 Allowed 'Trans proline' 0 N--CA 1.502 1.981 0 C-N-CA 123.346 2.698 . . . . 0.0 114.817 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.463 HD21 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -61.84 -20.31 63.53 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.134 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.526 ' HA ' HE22 ' A' ' 55' ' ' GLN . 16.5 mt -65.92 127.35 31.68 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.036 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.543 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.0 t-20 -50.18 147.13 4.37 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.072 0.857 . . . . 0.0 110.089 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -50.38 -39.83 47.84 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.53 -41.85 71.99 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.473 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.543 HE21 ' H ' ' A' ' 23' ' ' ASN . 33.4 mt-30 -61.2 -38.48 86.74 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -54.51 -63.51 1.13 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.923 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -61.52 -33.38 73.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.248 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.82 -59.35 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -61.21 -44.77 96.76 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.63 -42.0 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.098 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 46.5 mmm-85 -77.61 -33.73 53.61 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.504 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.4 p -58.13 -31.82 67.56 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.708 -0.224 . . . . 0.0 110.92 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -41.42 86.06 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.708 0.289 . . . . 0.0 110.395 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -65.35 -44.1 88.75 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.579 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.8 -38.39 81.79 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.556 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.54 88.63 3.95 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.521 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.0 -18.69 64.68 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.292 1.995 . . . . 0.0 111.982 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -60.88 -24.53 66.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.482 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.63 6.65 45.63 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.8 m -41.41 -47.44 3.61 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.84 -44.0 86.84 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -65.56 -44.89 85.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.307 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.8 mt -58.87 -42.55 89.69 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.297 0.373 . . . . 0.0 111.151 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.9 tp -60.82 -47.92 84.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.38 -43.09 99.64 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.669 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -61.75 -37.42 84.21 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.876 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.22 92.22 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -63.03 -36.22 82.85 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.652 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.18 -44.07 92.17 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.02 -43.06 99.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.956 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.463 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -61.07 -47.98 83.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 179.027 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.57 -38.83 88.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.221 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.65 -51.33 17.11 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.161 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.526 HE22 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt-30 -65.95 -27.25 68.02 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.878 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.35 145.74 35.6 Favored Pre-proline 0 N--CA 1.472 0.668 0 O-C-N 123.112 0.257 . . . . 0.0 111.597 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -74.78 153.49 42.97 Favored 'Trans proline' 0 N--CA 1.499 1.826 0 C-N-CA 122.858 2.372 . . . . 0.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.488 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.2 tptp . . . . . 0 N--CA 1.471 0.582 0 N-CA-C 111.507 0.188 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -62.73 -34.11 76.52 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.8 ttm -61.72 -47.2 86.35 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.198 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.44 -37.12 82.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.776 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -59.1 -54.81 42.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.952 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.38 68.44 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 121.205 -0.198 . . . . 0.0 111.161 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -55.44 -63.87 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.812 0.339 . . . . 0.0 111.271 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.79 -36.78 78.7 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.843 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -58.68 -42.76 89.28 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.184 -0.207 . . . . 0.0 110.92 -179.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 84.5 mt -65.95 -46.92 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -30.16 66.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.314 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.01 -36.2 76.7 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.296 0.372 . . . . 0.0 111.581 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.01 120.32 62.97 Favored Pre-proline 0 CA--C 1.543 0.673 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -88.48 -26.28 0.61 Allowed 'Trans proline' 0 N--CA 1.502 2.008 0 C-N-CA 123.717 2.945 . . . . 0.0 116.327 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 p30 -85.36 -1.78 57.37 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.516 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.2 mt -70.44 139.25 51.73 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.553 ' H ' HE21 ' A' ' 26' ' ' GLN . 21.7 t-20 -55.92 140.67 42.06 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.451 0.469 . . . . 0.0 110.853 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -45.9 -40.08 9.6 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -70.36 -45.07 66.82 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.238 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.553 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -60.59 -38.14 83.65 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.129 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -54.93 -55.84 26.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.476 0.179 . . . . 0.0 111.31 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.3 mtt85 -71.1 -33.31 70.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.216 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.75 -57.9 10.91 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -59.74 -46.0 90.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.23 -39.53 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -67.55 -42.22 83.0 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.881 0.372 . . . . 0.0 110.175 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -60.08 -35.15 74.54 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.035 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.41 -51.31 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 123.356 0.41 . . . . 0.0 110.761 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.85 -42.52 97.56 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.973 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.63 -37.76 85.18 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.674 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -142.17 79.31 16.15 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 123.159 0.287 . . . . 0.0 110.965 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -55.35 -25.09 46.06 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.79 2.327 . . . . 0.0 112.534 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -59.92 -31.27 69.67 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.464 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -91.94 4.11 53.72 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.256 0.347 . . . . 0.0 111.405 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.5 p -40.02 -55.28 2.09 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.78 -39.0 92.85 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.123 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -68.4 -49.21 61.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.48 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.27 -41.42 79.68 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.286 0.366 . . . . 0.0 111.15 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -61.86 -49.7 75.2 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.39 96.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.821 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -63.34 -38.3 90.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.585 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.69 -42.47 95.31 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -63.25 -36.13 82.65 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.584 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -59.73 -44.52 93.74 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.147 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.4 mt -62.92 -42.78 99.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.976 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -60.95 -48.23 82.77 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.338 178.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -62.05 -38.59 89.32 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.435 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.92 -51.46 12.4 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.516 HE22 ' HA ' ' A' ' 22' ' ' LEU . 17.4 mt-30 -66.32 -27.88 68.25 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.75 150.91 24.77 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.179 0.3 . . . . 0.0 111.601 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.67 153.61 69.15 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 122.927 2.418 . . . . 0.0 112.224 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.8 mptt . . . . . 0 C--O 1.221 -0.404 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.4 -179.866 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 tptm . . . . . 0 C--O 1.241 0.632 0 CA-C-O 120.747 0.308 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -61.11 -33.99 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.538 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.13 -42.94 99.61 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -62.73 -38.88 92.24 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -63.31 -52.77 60.55 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.131 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.42 74.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.037 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -55.97 -56.06 25.27 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.994 0.426 . . . . 0.0 110.988 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -69.97 -43.37 71.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.657 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -58.45 -47.93 82.38 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.277 0.361 . . . . 0.0 111.476 -178.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -63.58 -49.64 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.19 -30.47 66.47 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.523 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -60.52 -36.03 77.39 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.86 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.03 120.4 63.73 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.206 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -87.84 -18.22 2.45 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.606 2.871 . . . . 0.0 115.672 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.531 HD21 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -87.83 -5.19 58.73 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -177.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.499 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -74.03 132.08 42.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.792 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.574 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.3 t-20 -54.89 151.5 8.58 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.985 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -54.47 -39.93 67.95 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.78 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -71.65 -45.55 61.65 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.068 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.574 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.5 mt-30 -61.26 -45.15 95.69 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.071 -178.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.05 -52.18 66.46 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.174 0.296 . . . . 0.0 111.11 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -66.21 -33.84 76.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.271 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.77 96.73 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.18 -0.463 . . . . 0.0 112.172 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -61.29 -62.07 2.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.8 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.5 mt -56.21 -41.85 71.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 123.119 0.262 . . . . 0.0 111.527 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -62.79 -51.01 68.78 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 120.964 0.411 . . . . 0.0 110.306 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 89.5 p -64.05 -23.9 67.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.245 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -46.51 89.68 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -64.3 -44.47 91.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.371 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -61.41 -38.27 86.48 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.303 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -135.59 81.54 41.6 Favored Pre-proline 0 CA--C 1.549 0.909 0 O-C-N 123.398 0.436 . . . . 0.0 110.347 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -63.18 -17.46 60.25 Favored 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 121.909 1.739 . . . . 0.0 112.461 -179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.7 p -65.2 -26.59 68.2 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.23 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -101.96 4.44 39.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.7 m -45.05 -38.91 5.26 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.31 -45.98 74.9 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.702 0.286 . . . . 0.0 110.346 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.68 -46.06 80.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.7 -41.24 81.3 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.336 0.397 . . . . 0.0 111.014 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.9 tp -61.08 -49.02 79.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.9 99.56 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.821 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -61.37 -39.31 90.17 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.841 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.46 97.42 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -65.3 -35.67 81.72 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.711 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -59.39 -47.35 85.77 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.54 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -63.66 -38.16 90.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.19 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.531 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.77 -48.67 78.14 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.869 178.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.21 -38.54 89.55 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.14 -51.25 18.63 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.092 -178.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.499 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.7 mt-30 -66.29 -26.18 67.2 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.912 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.31 145.9 34.49 Favored Pre-proline 0 N--CA 1.471 0.611 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.16 153.5 46.29 Favored 'Trans proline' 0 N--CA 1.498 1.78 0 C-N-CA 122.926 2.417 . . . . 0.0 112.376 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 89.7 mttt . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.524 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 tptm . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 120.514 0.197 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.99 -40.13 92.32 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.4 mtt -64.4 -38.68 91.87 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.163 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -59.76 -40.0 86.69 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.308 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -64.33 -54.99 24.39 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.53 -34.0 76.82 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.933 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CE2' HD13 ' A' ' 31' ' ' ILE . 35.6 t80 -57.88 -57.55 12.3 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.856 0.36 . . . . 0.0 111.439 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -68.99 -44.95 71.82 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.436 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -59.44 -46.4 88.84 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.606 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.55 -42.85 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.296 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.22 -32.57 70.08 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.084 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.54 -33.76 76.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.719 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -61.99 119.12 45.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 122.958 0.161 . . . . 0.0 111.115 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -89.59 -42.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 123.583 2.855 . . . . 0.0 114.796 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.86 -36.82 75.22 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.6 HD11 ' HA ' ' A' ' 52' ' ' ASN . 8.6 mp -63.62 130.43 44.25 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.326 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.467 ' H ' HE21 ' A' ' 26' ' ' GLN . 62.7 t30 -51.12 146.94 5.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.407 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -53.78 -38.07 64.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.652 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.64 -43.04 99.81 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.364 0.415 . . . . 0.0 110.457 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.467 HE21 ' H ' ' A' ' 23' ' ' ASN . 34.6 mt-30 -65.65 -43.48 89.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.361 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -62.68 -50.93 69.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.578 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -62.06 -40.97 97.59 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.681 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.61 -34.46 77.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.791 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -63.41 -59.07 5.16 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.175 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.534 HD13 ' CE2' ' A' ' 13' ' ' TYR . 63.6 mt -61.74 -32.99 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.704 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.09 -46.36 71.2 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.216 0.532 . . . . 0.0 109.683 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 96.5 p -64.99 -21.93 66.92 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.993 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.461 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -59.62 -48.64 80.86 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -66.35 -41.8 89.02 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.716 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.76 -36.82 84.29 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.385 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -147.66 78.6 9.86 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.228 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.61 -27.73 85.35 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.544 2.163 . . . . 0.0 112.437 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 m -58.99 -30.34 67.9 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.703 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.8 5.76 44.68 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.5 t -45.51 -38.09 5.97 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.3 0.5 . . . . 0.0 111.777 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.06 -46.52 70.84 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.319 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -66.88 -45.84 76.83 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 34' ' ' LEU . 97.7 mt -57.11 -41.66 79.39 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.546 0.529 . . . . 0.0 110.99 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.72 -49.21 75.97 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.59 81.97 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.839 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -62.5 -32.88 73.87 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.488 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.13 -41.75 90.04 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -61.44 -35.21 76.96 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.891 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.42 -51.31 66.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.03 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 51' ' ' LEU . 89.1 mt -63.51 -39.46 94.49 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.045 179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.6 ' HA ' HD11 ' A' ' 22' ' ' LEU . 20.0 t-20 -56.64 -47.93 78.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.08 -31.88 72.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.389 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -53.12 34.69 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.452 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.8 mt-30 -80.89 -26.24 36.97 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.73 157.17 8.06 Favored Pre-proline 0 N--CA 1.472 0.667 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.94 159.05 4.13 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 123.0 2.467 . . . . 0.0 112.464 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt . . . . . 0 CA--C 1.546 0.819 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.604 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 C--O 1.24 0.599 0 CA-C-O 120.966 0.413 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.87 -35.03 77.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.319 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.9 mtt -62.04 -41.55 98.24 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.246 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -62.33 -42.94 99.79 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.348 0.405 . . . . 0.0 109.926 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -61.92 -50.3 72.71 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.35 -31.77 71.4 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.017 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -56.19 -56.62 18.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.819 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.73 -41.28 79.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.069 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -58.67 -42.88 89.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 121.176 -0.209 . . . . 0.0 111.451 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.32 -52.2 55.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.98 68.1 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.402 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.2 tp -60.59 -36.48 78.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.598 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.12 119.67 71.6 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -88.18 -24.22 1.02 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 123.651 2.901 . . . . 0.0 115.69 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.551 HD21 ' ND2' ' A' ' 52' ' ' ASN . 2.0 p30 -80.6 -6.3 58.09 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.526 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.6 mt -71.7 132.2 44.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.941 -0.703 . . . . 0.0 109.202 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.573 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.2 t30 -51.73 151.96 3.11 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.712 0.633 . . . . 0.0 110.926 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -50.95 -40.79 58.26 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -74.93 -48.04 26.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.849 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.573 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.2 mt-30 -59.73 -45.7 91.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.226 -178.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 ttmm -56.59 -47.36 79.74 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.287 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -79.54 -32.13 42.14 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.873 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -45.56 91.54 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -59.24 -58.63 7.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.544 -0.462 . . . . 0.0 112.054 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -54.94 -46.05 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 O-C-N 123.094 0.246 . . . . 0.0 111.557 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -62.88 -47.24 84.16 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.767 0.318 . . . . 0.0 110.547 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -61.22 -30.61 70.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.002 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -44.89 92.58 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.07 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.24 -39.53 94.14 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.575 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -67.14 -38.45 85.57 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.706 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -140.06 74.82 30.35 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.225 0.328 . . . . 0.0 110.454 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.87 -16.41 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 112.428 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.2 m -61.48 -29.71 70.14 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.15 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.464 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 51.2 mm-40 -105.06 9.71 34.27 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.8 m -44.29 -35.08 2.16 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.21 69.39 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.204 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.464 ' ND2' ' HB3' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -71.0 -37.03 72.66 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.24 -178.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.08 -44.46 96.63 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.64 -48.43 81.81 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.74 91.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.846 178.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -63.72 -37.24 86.61 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.806 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.31 93.81 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -63.5 -35.65 81.17 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.943 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -59.13 -47.99 83.26 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.571 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.32 -38.84 92.72 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.174 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.551 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.52 -48.26 80.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.885 178.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.46 -38.48 89.99 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.086 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.28 -51.26 15.8 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.526 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.2 mt-30 -65.37 -26.84 68.19 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.37 157.31 4.97 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.15 0.281 . . . . 0.0 111.672 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.2 156.51 5.27 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 123.101 2.534 . . . . 0.0 112.954 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.883 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt . . . . . 0 C--O 1.24 0.574 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -61.1 -39.26 89.27 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.498 ' SD ' ' CD2' ' A' ' 34' ' ' LEU . 1.6 mmm -62.8 -43.27 99.23 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.932 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -60.18 -40.11 88.84 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.293 0.37 . . . . 0.0 110.571 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -59.64 -55.85 29.26 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.305 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.68 -29.99 66.44 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -57.24 -59.67 4.76 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.867 0.365 . . . . 0.0 111.179 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -67.85 -42.55 81.22 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.121 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.25 -46.44 89.79 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.129 0.268 . . . . 0.0 111.52 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.48 -47.44 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.274 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.4 -29.38 66.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.533 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -59.88 -36.73 77.54 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 123.264 0.352 . . . . 0.0 111.471 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 120.98 69.4 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -86.88 -34.44 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.258 2.639 . . . . 0.0 114.652 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.49 HD21 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -64.42 -19.29 65.43 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HA ' HE22 ' A' ' 55' ' ' GLN . 13.1 mt -64.0 132.1 49.6 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.938 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.539 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.7 t-20 -55.58 143.18 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -50.23 -39.14 43.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -67.03 -43.95 81.48 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.86 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.539 HE21 ' H ' ' A' ' 23' ' ' ASN . 32.7 mt-30 -62.5 -36.96 84.17 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.883 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -59.31 -62.94 1.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 110.694 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.29 -34.94 74.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.15 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.15 -48.45 81.56 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.412 0.445 . . . . 0.0 111.986 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.56 -61.43 2.59 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.253 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.46 HD13 ' CD2' ' A' ' 13' ' ' TYR . 51.4 mt -54.51 -39.42 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 O-C-N 123.336 0.397 . . . . 0.0 111.963 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.84 -50.49 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.7 m -63.53 -34.93 78.87 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.829 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.498 ' CD2' ' SD ' ' A' ' 9' ' ' MET . 3.9 tt -59.11 -42.22 90.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.955 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -63.11 -45.42 92.09 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.53 -36.76 85.25 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.452 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -139.14 82.0 20.21 Favored Pre-proline 0 CA--C 1.545 0.761 0 O-C-N 123.334 0.396 . . . . 0.0 111.521 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.7 -17.38 49.26 Favored 'Trans proline' 0 N--CA 1.505 2.149 0 C-N-CA 122.499 2.132 . . . . 0.0 111.993 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.7 m -57.26 -33.78 67.96 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.288 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -91.62 -0.59 57.59 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 123.187 0.304 . . . . 0.0 111.521 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.6 t -46.11 -37.78 7.28 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 117.694 0.224 . . . . 0.0 111.579 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -45.51 70.5 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -66.82 -47.27 72.53 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.051 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.52 -40.45 82.93 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.305 0.378 . . . . 0.0 110.752 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 15.4 tp -61.02 -49.04 79.01 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.703 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -61.44 -38.16 86.15 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.655 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.1 96.43 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 tttt -64.52 -37.57 88.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.161 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -60.65 -44.3 96.59 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.794 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 51' ' ' LEU . 78.1 mt -62.45 -44.57 96.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.508 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.49 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -59.5 -48.14 82.79 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.401 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.25 -37.95 84.95 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.036 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.01 17.42 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.954 -178.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.522 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.1 mt-30 -65.34 -27.25 68.46 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.894 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -52.92 151.76 8.11 Favored Pre-proline 0 N--CA 1.475 0.777 0 O-C-N 123.213 0.321 . . . . 0.0 111.835 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.4 170.41 4.22 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.742 2.294 . . . . 0.0 112.152 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.7 mttt . . . . . 0 N--CA 1.477 0.913 0 O-C-N 124.285 0.991 . . . . 0.0 110.778 179.96 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 mptt . . . . . 0 C--O 1.238 0.488 0 CA-C-O 120.73 0.3 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -61.25 -34.13 74.65 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.67 -42.92 99.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.432 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.44 -38.74 92.3 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -63.59 -53.89 44.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.766 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -31.83 72.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.057 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -56.72 -56.11 25.56 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.02 0.438 . . . . 0.0 110.594 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -68.38 -44.58 74.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.588 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.35 -42.05 94.9 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.0 mt -65.01 -49.78 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.37 -25.13 61.69 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.17 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.02 -37.68 74.77 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.356 0.41 . . . . 0.0 111.98 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.9 mm? -69.93 119.9 74.44 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -89.01 -20.73 1.39 Allowed 'Trans proline' 0 N--CA 1.5 1.899 0 C-N-CA 123.208 2.605 . . . . 0.0 115.134 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 p30 -86.97 -2.57 58.72 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.736 HD23 HE22 ' A' ' 55' ' ' GLN . 39.8 mt -71.36 135.13 47.16 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.387 178.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.54 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -51.33 143.64 11.13 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.586 0.554 . . . . 0.0 110.095 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -47.97 -39.96 20.99 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.403 0.439 . . . . 0.0 112.152 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.65 -44.4 74.19 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.023 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.54 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.5 mt-30 -62.68 -36.95 84.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.111 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -57.55 -56.78 17.43 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.666 0.269 . . . . 0.0 110.973 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -68.71 -34.53 75.8 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.182 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.61 -52.41 63.89 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -59.45 -61.25 2.76 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 120.422 -0.511 . . . . 0.0 112.118 -178.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.7 -41.67 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.188 0.305 . . . . 0.0 111.657 -178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.0 ttt-85 -63.28 -49.28 74.68 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.924 0.392 . . . . 0.0 110.175 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 57.1 m -61.19 -30.22 70.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.024 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.14 -43.86 92.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.061 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -66.17 -41.95 89.6 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.011 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -43.11 88.41 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.876 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -135.94 74.51 57.03 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.018 0.437 . . . . 0.0 110.638 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -60.68 -11.03 15.75 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.486 2.124 . . . . 0.0 113.11 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.4 p -62.02 -25.08 67.45 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.83 16.81 19.4 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -48.56 -37.24 17.32 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.86 -45.23 90.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.425 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -64.3 -47.17 80.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.113 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.81 -41.86 78.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.408 0.443 . . . . 0.0 111.267 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.56 -49.99 75.34 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.03 99.74 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.764 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -59.92 -38.08 81.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.864 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -47.76 81.01 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -62.53 -37.78 87.43 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.336 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -60.2 -45.29 93.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.272 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 mt -64.87 -39.8 94.13 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -60.02 -49.1 79.0 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.429 0.456 . . . . 0.0 110.307 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.63 -38.87 89.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.265 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.51 -51.37 14.93 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.736 HE22 HD23 ' A' ' 22' ' ' LEU . 19.1 mt-30 -65.45 -27.94 68.87 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.614 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.34 145.0 59.96 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.288 0.367 . . . . 0.0 111.467 -179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.47 151.62 47.92 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.923 2.415 . . . . 0.0 112.261 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt . . . . . 0 C--O 1.223 -0.329 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.408 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.569 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -40.84 97.36 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.507 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -58.49 -41.29 84.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.457 0.473 . . . . 0.0 110.806 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -63.22 -54.97 29.07 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.146 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.55 78.24 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.291 -179.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -55.89 -53.01 61.94 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.904 0.383 . . . . 0.0 111.153 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.4 t90 -67.54 -46.38 72.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.219 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.41 -43.5 96.65 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.846 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 93.2 mt -64.74 -48.96 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -31.34 68.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.304 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.51 -35.96 77.2 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.295 0.372 . . . . 0.0 111.531 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -67.67 120.24 71.95 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -88.62 -26.92 0.49 Allowed 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 123.663 2.908 . . . . 0.0 116.297 -178.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -83.71 -0.66 51.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -176.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.0 mt -72.28 135.21 45.92 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.319 178.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.542 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.4 t-20 -54.11 142.84 24.15 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.654 0.596 . . . . 0.0 110.234 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -47.6 -42.63 24.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -66.61 -41.47 88.34 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.287 0.367 . . . . 0.0 111.383 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.542 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.98 -41.36 95.51 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.063 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -52.99 -54.38 35.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.717 0.294 . . . . 0.0 111.172 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -71.43 -36.05 71.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.401 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.83 -55.37 36.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -60.25 -54.13 49.4 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.9 mt -58.22 -41.1 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.188 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -64.81 -48.03 75.88 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.04 0.447 . . . . 0.0 109.999 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.2 t -61.81 -24.99 67.22 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.361 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.14 -43.94 98.11 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.649 0.593 . . . . 0.0 109.52 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -67.18 -39.9 86.5 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -64.6 -30.63 71.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.339 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -144.74 76.62 13.96 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 120.771 0.319 . . . . 0.0 110.683 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -54.42 -31.41 68.27 Favored 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.987 2.458 . . . . 0.0 112.698 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -59.36 -28.45 66.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.203 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -92.74 1.88 57.04 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.2 t -44.02 -41.66 5.57 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.69 -46.0 76.99 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.667 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -67.18 -46.11 74.95 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.181 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -57.73 -43.45 85.34 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.159 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.7 tp -60.92 -49.87 75.72 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.38 97.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.804 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -62.57 -39.02 92.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.348 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -40.95 97.13 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -63.81 -36.38 83.71 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.586 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -59.81 -44.31 94.05 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.15 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.54 -43.09 99.67 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.1 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.24 -48.38 81.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.29 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -61.76 -38.42 87.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.494 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.47 -51.55 11.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.522 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.5 mt-30 -65.8 -27.92 68.63 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 146.04 56.64 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.166 0.291 . . . . 0.0 111.485 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.82 153.76 58.77 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.997 2.465 . . . . 0.0 112.22 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mttp . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.484 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.2 mttt . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.98 -43.19 99.47 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.362 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.667 ' SD ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -63.17 -44.72 94.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.967 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -57.68 -41.43 81.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.318 0.387 . . . . 0.0 111.05 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -61.01 -57.14 13.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.465 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -30.33 68.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.456 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CD2' HD13 ' A' ' 31' ' ' ILE . 42.0 t80 -56.37 -58.99 5.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.895 0.379 . . . . 0.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -65.74 -43.26 89.49 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.652 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -59.91 -50.75 72.56 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.186 0.303 . . . . 0.0 111.27 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 89.7 mt -63.57 -47.08 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 120.575 0.226 . . . . 0.0 110.484 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.41 -29.42 64.11 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.64 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -60.65 -36.98 80.04 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.241 0.338 . . . . 0.0 111.641 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.32 120.02 61.31 Favored Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -88.85 -26.18 0.55 Allowed 'Trans proline' 0 N--CA 1.503 2.038 0 C-N-CA 123.696 2.931 . . . . 0.0 116.28 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -84.62 -0.44 53.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.528 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.6 mt -72.84 135.65 45.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.579 178.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.532 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.9 t-20 -53.89 143.52 21.15 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.698 0.624 . . . . 0.0 110.136 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -47.85 -40.74 22.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -68.8 -43.13 76.26 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.684 0.278 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.532 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.6 mt-30 -63.81 -37.73 88.48 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.273 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -56.36 -55.07 38.03 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.733 0.302 . . . . 0.0 111.279 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm180 -72.21 -31.9 66.27 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.494 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.1 -50.34 73.1 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.4 -55.41 31.8 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 13' ' ' TYR . 49.2 mt -56.79 -38.34 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 122.966 0.166 . . . . 0.0 111.31 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 mmm-85 -65.94 -42.29 90.24 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.5 t -61.89 -30.58 70.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.084 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.667 HD12 ' SD ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -53.51 -51.07 63.99 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.781 179.577 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.27 -39.51 94.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -56.98 -38.08 72.52 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.599 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.92 104.62 1.15 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 121.165 -0.214 . . . . 0.0 111.19 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.18 -17.39 59.54 Favored 'Trans proline' 0 N--CA 1.502 1.971 0 C-N-CA 121.898 1.732 . . . . 0.0 111.69 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.3 p -59.52 -30.71 68.77 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -96.39 1.14 51.49 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.124 0.265 . . . . 0.0 111.461 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.3 p -43.7 -51.82 6.88 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.54 91.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.744 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -69.11 -49.06 60.5 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.295 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.2 mt -56.72 -45.09 82.09 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.495 0.497 . . . . 0.0 110.923 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.99 -52.21 66.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.27 86.68 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.056 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -62.54 -37.72 87.22 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.261 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.64 95.65 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -63.54 -35.47 80.58 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.783 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -59.64 -47.14 86.77 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.342 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.9 mt -63.36 -39.74 95.36 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.335 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -61.3 -48.43 81.43 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.316 0.385 . . . . 0.0 110.114 178.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -62.4 -38.68 90.6 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.312 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.34 -51.56 12.88 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.528 HE22 ' HA ' ' A' ' 22' ' ' LEU . 18.7 mt-30 -66.35 -27.93 68.27 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.23 146.44 61.97 Favored Pre-proline 0 CA--C 1.537 0.466 0 O-C-N 123.206 0.316 . . . . 0.0 111.327 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.18 158.8 55.16 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.846 2.364 . . . . 0.0 111.989 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt . . . . . 0 CA--C 1.541 0.609 0 O-C-N 124.059 0.85 . . . . 0.0 110.923 -179.975 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 120.498 0.19 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.28 -44.22 97.59 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.361 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -38.73 92.22 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -59.21 -39.22 81.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.63 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -65.26 -55.24 19.54 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.057 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.8 -34.96 79.07 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.949 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -56.57 -52.95 62.88 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.214 0.531 . . . . 0.0 110.625 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -62.53 -46.01 90.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.775 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -61.09 -42.31 98.27 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -178.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.3 mt -62.34 -53.86 41.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 120.638 0.256 . . . . 0.0 110.421 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.83 -30.58 67.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.37 -37.14 79.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 123.242 0.339 . . . . 0.0 111.203 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.65 120.8 68.92 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.14 -21.6 1.57 Allowed 'Trans proline' 0 N--CA 1.504 2.134 0 C-N-CA 123.824 3.016 . . . . 0.0 116.236 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -89.85 -0.15 57.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -176.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.8 mt -74.89 138.37 42.39 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.85 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.579 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.3 t-20 -60.94 145.93 48.65 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.834 178.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -51.38 -42.38 61.35 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.06 -37.95 81.86 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.221 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.579 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.3 mt-30 -67.32 -53.96 24.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 28' ' ' ARG . 1.5 ptpm? -56.34 -48.58 76.49 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.68 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.419 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 77.9 mtt85 -63.25 -33.44 75.51 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.763 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.66 -55.64 16.42 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -60.0 -41.2 91.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.146 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 mm -57.05 -42.3 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -72.55 -35.69 68.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.194 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -57.51 -33.66 68.29 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.508 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 34' ' ' LEU . 2.8 mm? -51.72 -53.6 37.58 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.168 0.292 . . . . 0.0 110.368 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.16 -39.69 95.39 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.051 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.26 -40.86 95.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.503 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -151.31 82.92 5.63 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 123.243 0.339 . . . . 0.0 110.332 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.76 -24.97 80.18 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.411 2.074 . . . . 0.0 112.13 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -59.6 -33.15 71.1 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.172 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -88.76 8.69 27.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.439 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.3 p -43.35 -48.74 6.97 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.94 95.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.696 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.35 -47.26 61.84 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.294 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -58.14 -43.97 87.6 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.314 0.384 . . . . 0.0 110.857 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.78 -49.08 78.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.14 -41.92 97.6 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.881 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -62.89 -37.69 87.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.824 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.27 90.75 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -63.17 -36.31 83.21 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.624 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -58.54 -43.7 89.36 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.352 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 51' ' ' LEU . 75.6 mt -63.11 -41.98 99.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.988 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -62.68 -47.81 82.05 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.326 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -61.76 -37.86 85.85 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.348 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.78 -50.69 14.49 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.502 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.0 mt-30 -67.88 -27.46 66.68 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 -178.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 158.48 5.58 Favored Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.19 155.8 11.36 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.151 2.567 . . . . 0.0 112.993 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.3 mptt . . . . . 0 CA--C 1.534 0.357 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.414 -179.871 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -61.97 -41.82 98.44 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.742 -179.6 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.411 ' SD ' ' HB3' ' A' ' 38' ' ' PRO . 73.7 mtm -64.26 -37.05 86.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.878 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -61.04 -39.8 91.19 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -61.75 -43.47 98.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.953 179.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.05 -40.13 87.05 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.259 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -48.93 76.94 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.566 179.908 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -61.37 -44.41 97.21 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -61.36 -39.93 92.45 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 82.0 mt -60.97 -52.77 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.279 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.31 -31.42 67.49 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.424 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.99 -35.76 77.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.573 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -70.26 121.71 84.05 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.495 -179.282 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -87.34 -22.81 1.59 Allowed 'Trans proline' 0 N--CA 1.507 2.268 0 C-N-CA 123.823 3.015 . . . . 0.0 115.259 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.95 79.98 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -177.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.692 HD12 ' H ' ' A' ' 22' ' ' LEU . 4.1 mp -73.01 132.31 43.23 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.977 0.417 . . . . 0.0 111.025 -178.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' H ' HE21 ' A' ' 26' ' ' GLN . 0.2 OUTLIER -55.36 156.98 3.97 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.101 179.857 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -57.07 -42.13 80.04 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.305 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -43.92 96.1 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.859 -179.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.531 HE21 ' H ' ' A' ' 23' ' ' ASN . 35.4 mt-30 -62.99 -39.06 93.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.71 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -58.4 -64.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.935 -179.384 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -59.58 -34.22 72.44 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.721 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.24 -43.77 95.79 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.281 0.363 . . . . 0.0 111.53 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -63.54 -52.52 60.77 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.93 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.0 mm -56.41 -46.03 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -61.49 -47.79 84.03 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 120.679 0.276 . . . . 0.0 110.358 179.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.8 t -62.34 -30.46 71.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.246 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.18 -51.47 69.6 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.449 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -62.28 -40.52 96.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.678 179.086 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.77 -40.05 93.81 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.116 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -136.76 82.89 31.01 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.668 -179.357 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.411 ' HB3' ' SD ' ' A' ' 9' ' ' MET . 51.7 Cg_exo -53.49 -28.23 44.01 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.869 2.379 . . . . 0.0 112.424 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.5 -35.01 73.32 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.008 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -82.66 -1.47 51.21 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.0 p -41.31 -54.43 3.0 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.74 92.35 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -67.95 -50.22 57.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.745 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -57.05 -40.76 77.43 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 123.091 0.244 . . . . 0.0 111.15 -178.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.4 tp -61.49 -50.3 73.29 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.732 179.164 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.18 89.83 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.824 178.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -62.19 -36.5 82.1 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.58 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.58 -39.66 91.85 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -63.68 -39.65 94.84 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.609 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.83 -51.89 66.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.37 -36.3 83.57 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.458 ' HB2' HD11 ' A' ' 22' ' ' LEU . 0.8 OUTLIER -60.96 -49.11 78.79 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.371 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -63.68 -37.03 85.79 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.729 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.7 -52.25 13.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -177.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.461 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.5 mt-30 -68.31 -25.88 65.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 -179.052 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.52 149.45 39.79 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 123.06 0.225 . . . . 0.0 111.085 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.93 155.01 62.85 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 122.776 2.318 . . . . 0.0 112.272 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? . . . . . 0 N--CA 1.476 0.83 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.865 179.921 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -57.96 -46.49 85.01 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 120.803 0.335 . . . . 0.0 111.115 -178.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -50.3 72.32 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.48 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -55.78 -41.55 74.22 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 123.569 0.543 . . . . 0.0 111.61 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -58.42 -61.89 2.25 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.501 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.29 -23.52 64.76 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.294 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -58.71 -58.93 6.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . 0.449 ' CD1' ' C ' ' A' ' 14' ' ' TRP . 0.4 OUTLIER -73.58 -35.45 65.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.515 -178.937 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.68 -47.46 85.55 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.198 0.311 . . . . 0.0 110.793 -179.286 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.427 HG23 ' HB1' ' A' ' 48' ' ' ALA . 96.7 mt -68.58 -49.92 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.832 179.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.0 -24.94 42.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.773 -178.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.1 tp -56.7 -39.03 73.12 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.359 0.412 . . . . 0.0 111.899 -179.044 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.477 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.1 mm? -68.73 120.89 78.83 Favored Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -89.19 -9.94 4.18 Favored 'Trans proline' 0 N--CA 1.504 2.119 0 C-N-CA 123.597 2.865 . . . . 0.0 115.671 -178.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.4 p30 -95.84 -1.43 49.53 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.492 ' HA ' HE22 ' A' ' 55' ' ' GLN . 29.2 mt -75.25 130.36 38.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.69 178.759 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.524 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.8 t-20 -53.89 148.12 10.96 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.628 0.58 . . . . 0.0 109.612 179.158 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -53.05 -44.0 67.07 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -65.54 -42.17 92.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.177 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.524 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.0 mt-30 -65.22 -48.2 74.18 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.303 -179.428 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -61.34 -49.13 78.2 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 123.303 0.377 . . . . 0.0 110.688 -179.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.74 -39.51 91.84 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.641 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.03 -44.44 95.92 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.156 -179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -60.31 -56.93 15.53 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.649 -179.145 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.1 mt -57.89 -44.19 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 123.162 0.289 . . . . 0.0 110.978 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.7 ttt-85 -62.17 -50.02 73.5 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.843 0.354 . . . . 0.0 110.616 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 t -58.15 -29.31 65.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -45.61 91.46 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -64.12 -39.74 94.68 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.368 178.686 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -59.81 -36.29 76.47 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.05 92.68 2.58 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.82 -179.843 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.98 -18.68 51.63 Favored 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.381 2.054 . . . . 0.0 111.901 179.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.1 p -59.43 -25.32 64.24 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.811 -179.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -102.26 0.87 35.07 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.3 m -46.1 -39.74 9.86 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.78 84.1 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -67.3 -48.05 68.78 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.28 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.1 mt -57.46 -43.01 83.65 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.233 0.333 . . . . 0.0 111.056 -179.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.0 -50.96 71.69 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.26 0.553 . . . . 0.0 109.687 179.083 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.0 -41.33 96.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.04 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -63.72 -38.12 89.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.776 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.427 ' HB1' HG23 ' A' ' 16' ' ' ILE . . . -63.62 -44.69 93.19 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -63.49 -32.96 74.55 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.05 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -60.27 -47.47 85.85 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.953 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.8 mt -63.82 -37.11 86.15 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.004 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -62.66 -48.77 77.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.988 178.928 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.52 -38.75 91.18 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.88 -51.58 15.74 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.161 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.492 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.5 -27.5 67.83 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.067 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.48 145.44 48.74 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 123.237 0.335 . . . . 0.0 111.588 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.28 154.71 41.41 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 123.084 2.523 . . . . 0.0 112.476 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.392 179.805 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -62.95 -40.03 96.42 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.669 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -39.36 93.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.555 179.308 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -59.28 -43.59 92.51 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 123.378 0.424 . . . . 0.0 110.649 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -62.75 -50.83 69.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.268 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.05 78.34 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.139 -179.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -55.8 -55.82 27.87 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.969 0.414 . . . . 0.0 110.895 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -64.98 -45.66 84.73 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.442 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -58.61 -49.48 77.32 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.511 -178.515 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 85.6 mt -57.76 -50.17 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.662 0.268 . . . . 0.0 110.877 179.621 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.57 -25.42 64.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.935 -179.719 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -60.81 -38.28 84.86 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.238 0.336 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.51 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.4 mm? -66.58 121.11 75.72 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.016 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.75 -8.05 5.25 Favored 'Trans proline' 0 N--CA 1.503 2.031 0 C-N-CA 123.592 2.862 . . . . 0.0 115.587 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -98.97 -2.3 37.73 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.929 0.714 . . . . 0.0 112.929 -177.499 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.497 ' HA ' HE22 ' A' ' 55' ' ' GLN . 30.3 mt -75.98 130.9 39.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.451 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.625 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -52.28 145.61 10.65 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.199 179.407 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -50.79 -41.0 56.74 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.806 -178.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.59 -42.11 83.03 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.926 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.625 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.8 mt-30 -62.31 -42.18 99.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.697 -179.053 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm -55.42 -63.8 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.632 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -58.21 -32.24 68.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.247 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.77 -62.31 1.89 Allowed 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.174 0.297 . . . . 0.0 111.209 -179.068 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -61.55 -40.29 94.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.086 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.4 -39.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.291 179.025 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -75.1 -39.31 60.79 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.571 178.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.3 m -55.0 -35.45 64.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.544 -179.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.33 -43.98 71.7 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.248 0.342 . . . . 0.0 110.527 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -68.43 -41.01 80.97 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.173 178.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.22 -41.89 94.03 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.098 -178.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.17 85.21 6.98 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 120.862 0.363 . . . . 0.0 111.098 -179.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -54.83 -23.73 35.23 Favored 'Trans proline' 0 N--CA 1.502 1.988 0 C-N-CA 122.908 2.405 . . . . 0.0 112.755 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.7 p -61.91 -27.76 69.04 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.809 -179.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -96.13 8.01 44.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -178.666 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m -44.78 -40.87 6.45 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -178.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -45.39 75.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.788 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -67.52 -48.29 67.47 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.705 -179.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -57.33 -45.53 84.17 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.225 0.328 . . . . 0.0 111.291 -178.75 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.2 tp -60.1 -49.34 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.34 -40.5 94.49 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.817 178.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -64.17 -38.98 92.99 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 179.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.55 -46.55 82.32 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.558 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -63.27 -32.2 73.54 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.046 179.306 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.2 -44.44 95.11 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.897 179.112 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.7 mt -63.21 -39.42 94.57 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.906 178.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.452 ' ND2' HD12 ' A' ' 19' ' ' LEU . 16.4 t-20 -62.98 -49.14 75.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.247 178.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.42 -38.61 90.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.256 -179.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.52 -51.62 14.19 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.031 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.497 HE22 ' HA ' ' A' ' 22' ' ' LEU . 26.3 mt-30 -66.2 -27.34 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.132 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 145.33 60.13 Favored Pre-proline 0 CA--C 1.539 0.524 0 O-C-N 123.227 0.329 . . . . 0.0 111.266 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -74.74 153.45 43.14 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 122.895 2.396 . . . . 0.0 112.42 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.44 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.6 t . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.54 -67.86 0.42 Allowed 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.43 -61.48 1.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.383 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -176.93 152.4 0.93 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.178 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -79.35 56.21 2.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.437 0.637 . . . . 0.0 111.753 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -66.11 -29.02 69.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.487 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -56.5 -38.38 71.69 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.305 -0.407 . . . . 0.0 112.091 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -61.68 -40.01 93.44 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.406 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 12.6 mtt -66.0 -39.56 90.38 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.753 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -58.01 -45.1 87.44 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.502 0.501 . . . . 0.0 110.742 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.43 -51.31 68.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.91 68.26 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.109 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.98 -64.89 0.78 Allowed 'General case' 0 C--O 1.242 0.675 0 CA-C-O 120.796 0.331 . . . . 0.0 110.769 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -71.06 -36.23 72.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.91 -40.73 81.09 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.995 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.67 -44.73 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.89 64.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.157 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.15 -37.63 80.69 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.938 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.505 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.5 mm? -66.02 120.87 72.86 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 120.32 -0.552 . . . . 0.0 109.877 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.37 -7.89 5.66 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.665 2.91 . . . . 0.0 115.78 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.7 p30 -99.18 -2.17 37.46 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.491 ' HA ' HE22 ' A' ' 55' ' ' GLN . 32.4 mt -74.51 133.26 42.32 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.314 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.555 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -53.09 146.8 10.68 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.067 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -51.96 -40.7 61.28 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -68.24 -42.51 79.61 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.95 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.555 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.17 -43.37 95.35 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.716 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -57.15 -48.0 79.77 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.54 0.21 . . . . 0.0 111.16 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.31 -35.85 68.74 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.62 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.14 -56.77 17.91 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -59.95 -45.81 91.43 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.796 -0.361 . . . . 0.0 111.947 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.8 mt -58.6 -38.66 72.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.664 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -74.24 -32.53 63.01 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -58.23 -33.22 69.11 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.842 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -52.64 -50.27 63.5 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -63.27 -39.19 93.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.112 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.28 -38.28 79.77 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.701 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.46 84.53 2.55 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 120.859 0.361 . . . . 0.0 110.728 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.07 -25.22 44.1 Favored 'Trans proline' 0 N--CA 1.502 1.976 0 C-N-CA 122.834 2.356 . . . . 0.0 112.631 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.6 p -60.41 -30.91 69.91 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.556 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -92.08 8.83 36.0 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.171 0.295 . . . . 0.0 111.767 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.0 p -43.65 -50.86 7.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.45 92.95 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 123.322 0.389 . . . . 0.0 110.895 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -70.37 -49.62 47.31 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -57.0 -44.82 83.17 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.319 0.387 . . . . 0.0 111.054 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.9 tp -60.2 -48.64 80.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.96 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.81 -43.37 98.99 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -61.22 -38.89 88.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.939 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.92 88.4 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -63.1 -32.42 73.79 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.943 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -60.77 -43.66 97.75 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.84 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.82 -39.67 95.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.802 178.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.475 ' ND2' HD12 ' A' ' 19' ' ' LEU . 16.2 t-20 -63.42 -49.83 72.21 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.093 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.56 -38.57 90.57 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.21 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -51.55 15.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.491 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.9 mt-30 -65.83 -27.27 68.12 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.28 145.33 57.74 Favored Pre-proline 0 CA--C 1.54 0.558 0 O-C-N 123.144 0.278 . . . . 0.0 111.277 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.39 170.03 5.83 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.515 2.144 . . . . 0.0 111.805 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 CA--C 1.547 0.864 0 CA-C-O 117.565 -1.207 . . . . 0.0 110.606 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.453 ' O ' HG13 ' A' ' 1' ' ' VAL . 8.7 p . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.37 -65.89 0.76 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.929 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -90.38 -61.22 1.73 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.207 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 mmtp -178.05 155.35 0.95 Allowed 'General case' 0 N--CA 1.471 0.611 0 O-C-N 123.333 0.396 . . . . 0.0 110.4 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -90.37 47.16 1.4 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.483 0.659 . . . . 0.0 110.522 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.37 -26.45 30.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.565 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -55.98 -35.64 66.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.359 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.91 -40.52 96.67 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 121.09 -0.244 . . . . 0.0 110.655 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtm -62.14 -46.14 90.31 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.284 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -58.11 -39.72 79.35 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.507 0.505 . . . . 0.0 110.986 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -60.53 -57.56 12.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.153 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.35 68.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 31' ' ' ILE . 40.1 t80 -55.24 -58.77 6.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.202 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -71.09 -38.77 72.39 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -60.18 -43.13 96.09 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.962 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 87.7 mt -65.19 -47.53 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -30.85 68.2 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -59.51 -35.95 75.13 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.531 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mp -67.06 120.34 71.24 Favored Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -88.38 -26.23 0.64 Allowed 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 123.752 2.968 . . . . 0.0 116.247 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -84.66 -0.22 52.68 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.511 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.4 mt -73.5 132.91 43.42 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 120.167 -0.613 . . . . 0.0 109.525 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.539 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -50.62 145.49 6.68 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.815 0.697 . . . . 0.0 109.781 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -50.49 -40.3 50.69 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.36 -41.43 85.11 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.686 0.279 . . . . 0.0 111.004 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.539 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -65.23 -39.56 92.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.933 -179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -55.3 -53.75 52.21 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.646 0.26 . . . . 0.0 111.459 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -72.69 -34.03 66.9 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.432 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.68 -59.62 5.09 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -59.0 -47.04 86.62 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.413 HG23 ' CD2' ' A' ' 13' ' ' TYR . 57.1 mt -59.78 -37.32 70.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.214 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -69.72 -37.89 76.71 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.7 m -58.94 -32.86 69.98 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.613 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 34' ' ' LEU . 1.9 mm? -51.22 -56.59 12.08 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 120.788 0.328 . . . . 0.0 110.299 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -62.68 -38.62 91.08 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.179 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.96 -36.54 72.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.993 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -161.98 82.9 1.75 Allowed Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 120.647 0.261 . . . . 0.0 111.106 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -56.81 -19.16 30.1 Favored 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.81 2.34 . . . . 0.0 112.919 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 t -57.42 -34.5 68.99 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.095 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -104.86 18.08 22.97 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.105 0.253 . . . . 0.0 111.071 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.8 p -50.82 -39.01 52.13 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.83 -38.98 92.8 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.1 0.476 . . . . 0.0 109.934 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -68.59 -46.31 69.7 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.135 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.9 mt -57.35 -45.71 84.07 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.352 0.408 . . . . 0.0 111.289 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 tp -60.49 -49.38 77.8 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.59 -40.58 95.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.823 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -64.05 -39.59 94.42 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.654 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.05 95.42 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -64.85 -37.46 87.69 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.398 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -59.6 -43.25 93.77 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.219 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.1 mt -63.18 -43.06 99.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.949 179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -61.51 -48.24 81.96 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.261 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.35 -38.4 86.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.506 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.53 -51.52 11.54 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.511 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.0 mt-30 -66.3 -27.86 68.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.93 144.81 56.41 Favored Pre-proline 0 CA--C 1.539 0.529 0 O-C-N 123.157 0.286 . . . . 0.0 111.593 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.31 153.58 50.84 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 122.982 2.454 . . . . 0.0 112.326 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.418 179.817 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -78.27 0.06 Allowed 'General case' 0 CA--C 1.534 0.338 0 O-C-N 123.31 0.381 . . . . 0.0 110.479 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -90.28 -61.01 1.77 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.062 0.226 . . . . 0.0 110.849 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -169.37 149.6 4.09 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.103 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -82.36 51.24 1.78 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.458 0.647 . . . . 0.0 111.777 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.2 -33.55 74.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.198 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -54.95 -49.51 71.18 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.34 0.4 . . . . 0.0 111.802 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.66 -34.34 72.7 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.1 0.476 . . . . 0.0 109.989 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -43.64 97.14 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.949 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.98 -39.23 88.83 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.979 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -61.46 -55.94 25.63 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.846 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.65 74.26 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -55.69 -59.72 4.45 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.622 0.248 . . . . 0.0 111.34 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -71.08 -38.09 72.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.166 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.23 -41.65 89.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.802 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.76 -48.97 80.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.73 -30.6 67.6 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.0 tp -60.33 -36.27 77.56 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.663 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -64.42 120.69 67.35 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -87.83 -27.72 0.52 Allowed 'Trans proline' 0 N--CA 1.504 2.107 0 C-N-CA 123.765 2.977 . . . . 0.0 116.271 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -83.89 -0.5 51.55 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.507 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -72.94 135.98 45.11 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.373 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.542 ' H ' HE21 ' A' ' 26' ' ' GLN . 81.2 m-20 -55.11 144.94 22.25 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.537 0.523 . . . . 0.0 109.973 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -49.66 -41.51 43.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -66.16 -41.42 90.37 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.149 0.281 . . . . 0.0 110.912 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.542 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.7 mt-30 -65.44 -40.3 93.1 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.047 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.2 mtpp -55.69 -53.18 59.68 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.738 0.304 . . . . 0.0 111.235 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -70.41 -36.78 74.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.204 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.93 -58.37 8.83 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -58.64 -47.05 85.73 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -61.04 -37.95 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.431 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.6 ttt-85 -68.51 -41.86 79.39 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.4 m -58.97 -34.52 71.9 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.995 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.408 ' HG ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -55.89 -44.27 78.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.254 0.346 . . . . 0.0 110.543 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -66.94 -42.67 84.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.117 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.95 -39.54 90.54 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.033 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -137.09 77.27 43.23 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.179 0.3 . . . . 0.0 110.465 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.17 -24.27 78.81 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.355 2.036 . . . . 0.0 112.266 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.7 p -61.76 -30.53 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.332 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -90.68 5.27 48.79 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 123.27 0.356 . . . . 0.0 110.905 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 p -40.15 -53.96 2.38 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.87 92.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.277 0.361 . . . . 0.0 110.972 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -67.76 -47.11 70.14 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.184 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.408 HD12 ' HG ' ' A' ' 34' ' ' LEU . 91.7 mt -58.44 -40.84 83.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.258 0.349 . . . . 0.0 111.046 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.2 tp -61.76 -48.09 82.25 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.07 -43.12 99.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.704 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -62.21 -38.98 91.23 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.682 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.28 96.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -63.45 -36.65 84.46 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.555 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -59.2 -43.89 92.23 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.377 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.91 -43.81 97.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.029 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.35 -47.99 83.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -61.78 -38.35 87.73 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.533 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.43 -50.93 12.87 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.507 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.9 mt-30 -66.02 -27.85 68.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.18 144.82 58.9 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.192 0.308 . . . . 0.0 111.64 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.2 167.98 8.4 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 122.649 2.233 . . . . 0.0 112.021 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp . . . . . 0 CA--C 1.547 0.843 0 CA-C-O 117.436 -1.269 . . . . 0.0 110.762 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -74.13 -75.37 0.16 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.34 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.12 -61.3 1.71 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.738 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -171.9 147.97 2.25 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.205 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -79.81 58.0 2.71 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.548 0.69 . . . . 0.0 111.121 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -68.43 -30.13 68.95 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.563 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -54.45 -46.45 73.29 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -62.32 -37.54 85.97 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.469 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.54 -41.76 98.44 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.372 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.89 -39.1 87.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.418 0.449 . . . . 0.0 110.35 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -59.81 -54.84 41.54 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.772 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.89 -30.9 70.36 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.167 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -54.76 -57.84 9.93 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.692 0.282 . . . . 0.0 111.232 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -69.24 -39.9 78.23 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.83 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -60.92 -40.5 93.4 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.122 0.263 . . . . 0.0 111.111 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 71.6 mt -64.7 -52.08 59.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.33 -29.07 68.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.393 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.18 -32.88 71.49 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.473 0.483 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.0 OUTLIER -56.34 136.82 75.73 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.186 -178.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -90.47 -42.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 123.597 2.864 . . . . 0.0 116.592 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.86 -0.48 57.59 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.511 ' HA ' HE22 ' A' ' 55' ' ' GLN . 95.9 mt -65.48 137.82 57.69 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.672 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.624 ' H ' HE21 ' A' ' 26' ' ' GLN . 65.2 t30 -57.64 157.79 6.76 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -53.01 -51.28 62.17 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.12 -41.02 74.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.624 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.6 mt-30 -59.41 -42.47 91.86 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -59.78 -50.58 73.27 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.062 0.226 . . . . 0.0 111.003 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 -71.8 -32.08 67.24 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.414 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.02 -47.08 87.32 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -59.64 -53.11 61.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.89 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.0 mt -59.01 -39.87 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 122.977 0.173 . . . . 0.0 110.582 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -64.4 -43.95 92.79 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 120.968 0.413 . . . . 0.0 109.973 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.4 m -60.67 -32.68 71.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.82 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -46.97 76.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.097 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -64.59 -42.45 95.58 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.482 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.16 -36.9 81.05 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.49 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -151.51 88.41 4.32 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.587 0.232 . . . . 0.0 111.159 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -54.33 -24.92 36.74 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.755 2.303 . . . . 0.0 112.517 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -58.9 -33.6 70.72 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.449 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -86.35 1.23 51.91 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.7 p -40.03 -56.23 1.9 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.78 92.52 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.48 -47.47 66.99 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.594 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 36.8 mt -57.98 -41.5 83.12 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.408 0.443 . . . . 0.0 110.859 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.59 -50.76 71.32 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.89 83.22 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.023 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -61.76 -33.36 73.94 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.596 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -43.79 91.35 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -62.5 -36.41 82.44 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.197 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -63.35 -50.6 69.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.69 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.88 -41.98 99.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.463 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.627 ' HB2' HD13 ' A' ' 19' ' ' LEU . 8.0 t-20 -60.65 -47.47 86.1 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.216 0.322 . . . . 0.0 110.389 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.95 -38.52 91.38 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.114 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.44 -51.42 13.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.511 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.9 mt-30 -66.0 -27.99 68.54 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.77 146.46 66.49 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 123.133 0.271 . . . . 0.0 111.131 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.74 159.93 50.52 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.881 2.387 . . . . 0.0 112.047 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.471 0.624 0 O-C-N 124.018 0.824 . . . . 0.0 110.932 -179.922 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -73.74 -74.96 0.16 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.556 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.44 -61.28 1.71 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.928 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -168.88 144.76 3.44 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.262 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -84.33 52.27 2.3 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.352 0.596 . . . . 0.0 111.093 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' ND2' ' H ' ' A' ' 6' ' ' ASN . 3.1 p30 -85.22 -0.6 55.15 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.768 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -61.99 -48.59 79.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.074 0.464 . . . . 0.0 109.996 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -63.55 -35.95 82.18 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.123 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.2 mtt -61.69 -40.82 96.36 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.854 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -62.08 -42.65 99.43 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.395 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -59.66 -50.93 71.97 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.731 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.42 -29.71 67.5 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.002 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.447 ' CE2' HD13 ' A' ' 31' ' ' ILE . 55.9 t80 -56.9 -55.02 39.93 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.518 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -75.3 -36.19 61.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.86 -47.51 83.06 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.94 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.96 -50.39 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.267 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.29 -30.66 64.89 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.543 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -60.13 -36.76 78.22 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.402 0.439 . . . . 0.0 111.822 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.32 119.9 57.15 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -87.71 -22.18 1.6 Allowed 'Trans proline' 0 N--CA 1.503 2.063 0 C-N-CA 123.569 2.846 . . . . 0.0 115.516 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.529 HD21 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -82.62 -6.1 59.17 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.527 ' HA ' HE22 ' A' ' 55' ' ' GLN . 18.9 mt -72.99 131.53 42.27 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.662 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.578 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.5 t-20 -53.2 146.83 10.97 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.965 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -51.76 -41.44 61.61 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.0 -41.93 81.51 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.12 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.578 HE21 ' H ' ' A' ' 23' ' ' ASN . 29.6 mt-30 -63.17 -40.29 97.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.988 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -59.45 -57.72 11.75 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.762 0.315 . . . . 0.0 110.611 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -62.09 -33.82 75.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.831 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.84 95.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.869 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -60.71 -59.51 5.27 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.447 HD13 ' CE2' ' A' ' 13' ' ' TYR . 71.7 mt -56.4 -44.58 80.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 123.323 0.39 . . . . 0.0 111.293 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -62.01 -49.2 76.98 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.646 0.26 . . . . 0.0 110.759 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -63.7 -26.45 68.66 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.414 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.54 -47.27 86.32 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.511 0.507 . . . . 0.0 109.759 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.96 -42.81 97.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.875 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.6 -36.69 85.04 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.523 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -137.73 78.64 36.25 Favored Pre-proline 0 CA--C 1.541 0.597 0 O-C-N 123.333 0.396 . . . . 0.0 110.567 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.42 -19.87 66.12 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.406 2.071 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.8 m -61.39 -29.89 70.21 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.055 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -99.2 3.91 46.55 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.2 m -44.1 -40.47 4.94 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -47.11 72.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 110.26 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -63.52 -43.81 96.08 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.894 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -57.95 -40.89 81.64 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.187 0.305 . . . . 0.0 111.015 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.25 -45.88 92.67 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.63 94.73 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.568 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -61.32 -37.96 85.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.878 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.5 94.93 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -62.74 -35.52 80.05 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.744 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.06 -46.87 88.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.569 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.6 mt -63.33 -39.3 94.17 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.067 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.529 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -62.56 -48.84 77.73 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.014 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.06 -38.39 88.62 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.095 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.4 -51.13 18.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.938 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.527 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.2 mt-30 -65.96 -27.04 67.86 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.753 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 148.52 29.73 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.126 0.266 . . . . 0.0 111.46 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.42 158.12 58.97 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.787 2.325 . . . . 0.0 112.045 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.02 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.64 -74.06 0.1 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.903 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -89.48 -60.64 1.89 Allowed 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.2 tttp -176.43 153.92 1.24 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.106 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -78.67 55.85 1.74 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.433 0.635 . . . . 0.0 111.872 -179.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -70.79 -31.18 67.86 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.406 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -54.88 -44.5 74.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.52 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -61.68 -38.81 89.17 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.906 0.384 . . . . 0.0 110.26 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.75 -41.07 98.07 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.463 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -60.45 -38.95 85.81 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 123.33 0.394 . . . . 0.0 110.549 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -62.39 -51.36 67.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.658 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.11 -32.17 71.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.857 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -55.01 -61.48 2.28 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.004 0.43 . . . . 0.0 110.928 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.1 t90 -69.69 -42.01 74.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.686 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -57.93 -45.29 86.78 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.169 0.293 . . . . 0.0 111.282 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.2 -43.89 95.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.19 -28.84 67.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.2 tp -60.78 -36.37 78.8 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 123.357 0.411 . . . . 0.0 111.199 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.26 120.39 61.37 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -88.27 -20.35 1.77 Allowed 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 123.786 2.99 . . . . 0.0 116.289 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.3 p30 -91.42 -0.47 57.64 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' HA ' HE22 ' A' ' 55' ' ' GLN . 14.8 mt -71.53 137.62 48.25 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.414 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.583 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.0 t30 -57.14 148.63 21.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.031 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -52.55 -38.5 59.97 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.168 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -73.28 -39.45 65.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.33 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.583 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.1 mt-30 -66.28 -45.59 79.95 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -59.09 -43.01 91.8 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -72.37 -40.72 67.07 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.751 0.31 . . . . 0.0 110.764 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.8 97.73 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.243 -178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -61.8 -54.31 43.97 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.5 mt -60.77 -31.93 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -72.28 -42.76 65.18 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.055 0.455 . . . . 0.0 110.174 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.6 p -62.29 -26.08 68.21 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.438 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.418 HD22 HD13 ' A' ' 44' ' ' LEU . 1.4 mm? -53.51 -46.14 69.99 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 178.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.1 -39.75 71.91 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.152 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.79 -42.9 90.15 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.46 0.475 . . . . 0.0 111.963 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.85 82.59 9.23 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-O 120.872 0.368 . . . . 0.0 110.924 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -56.16 -20.15 30.03 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 122.856 2.371 . . . . 0.0 112.339 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 91.7 p -63.49 -27.7 69.46 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.735 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -99.58 5.11 46.04 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -43.49 -43.95 5.7 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.15 -46.24 81.68 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.879 0.371 . . . . 0.0 110.516 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.62 -43.93 92.15 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.323 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.418 HD13 HD22 ' A' ' 34' ' ' LEU . 82.9 mt -58.39 -42.74 87.75 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.277 0.36 . . . . 0.0 111.028 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.4 tp -60.51 -50.83 71.97 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.46 96.67 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -62.04 -36.49 81.76 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.442 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.69 98.78 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.7 tttt -64.12 -36.09 82.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.685 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -59.83 -44.76 93.88 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.227 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 51' ' ' LEU . 85.4 mt -60.7 -44.83 96.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.931 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -60.66 -48.56 81.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.544 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.06 -38.42 86.12 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.417 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.03 -51.49 12.22 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.502 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.0 mt-30 -65.48 -27.85 68.79 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.24 145.81 54.93 Favored Pre-proline 0 CA--C 1.537 0.468 0 O-C-N 123.155 0.284 . . . . 0.0 111.435 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.98 164.65 26.55 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.862 2.375 . . . . 0.0 111.791 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.398 -0.811 . . . . 0.0 111.112 179.874 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.6 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -89.39 179.54 6.06 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.779 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -53.98 -25.2 19.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.536 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.95 -42.02 2.66 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.215 0.606 . . . . 0.0 111.953 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -57.02 13.35 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.869 -178.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.8 -41.07 88.16 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -57.99 -59.94 4.49 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -177.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.44 -38.6 87.75 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.576 0.227 . . . . 0.0 111.478 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.0 ttm -61.51 -54.49 42.56 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.273 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.06 -39.1 71.55 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.265 0.353 . . . . 0.0 111.718 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -58.64 -62.77 1.62 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 121.097 -0.241 . . . . 0.0 111.192 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.19 -27.25 67.11 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.73 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -56.53 -59.81 4.44 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.603 0.24 . . . . 0.0 111.07 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -70.58 -39.18 74.02 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.85 -41.49 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.277 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -68.61 -48.78 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.75 -29.38 66.7 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.267 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.57 -36.81 76.94 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.345 0.403 . . . . 0.0 111.332 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.13 121.71 73.39 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -87.6 -21.84 1.72 Allowed 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.57 2.847 . . . . 0.0 116.186 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -91.91 -1.09 57.47 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.495 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.1 mt -70.28 137.09 50.44 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.398 178.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.525 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.6 t-20 -58.64 145.66 39.01 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.38 -40.35 68.09 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -65.7 -45.28 83.39 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.481 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.525 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -63.62 -35.95 82.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.58 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -61.32 -61.76 2.32 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.538 0.524 . . . . 0.0 110.004 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -60.05 -38.18 82.03 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.033 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.15 87.65 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -61.58 -60.82 3.11 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.736 -0.385 . . . . 0.0 111.172 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -56.06 -40.06 61.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 123.351 0.407 . . . . 0.0 111.637 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -62.33 -49.84 74.01 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 m -62.36 -32.69 73.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.815 178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.72 -44.79 90.53 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.076 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -63.43 -42.75 98.69 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.694 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.72 -36.96 82.46 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.211 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -147.65 86.39 6.29 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.167 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -60.95 -14.82 34.94 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 122.397 2.065 . . . . 0.0 112.253 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 t -57.81 -32.07 67.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.211 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -92.79 2.36 56.79 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.194 0.309 . . . . 0.0 111.415 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 60.7 p -44.32 -49.85 9.3 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.9 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -69.97 -48.8 56.83 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.127 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -58.28 -41.99 85.55 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.206 0.316 . . . . 0.0 110.905 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.4 -48.51 80.91 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.95 -41.18 97.68 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.674 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.14 -39.96 95.14 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.549 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.51 87.64 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -64.07 -38.21 90.25 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -62.58 -43.59 98.43 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.111 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.16 -47.26 85.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.485 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.4 -48.76 80.4 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.299 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.13 -38.6 83.54 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.067 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -51.28 15.54 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.967 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.495 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.18 -27.91 68.36 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.901 -179.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.37 144.77 50.72 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.259 0.349 . . . . 0.0 111.735 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.96 154.88 42.99 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 123.141 2.561 . . . . 0.0 112.356 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 118.121 -0.942 . . . . 0.0 110.543 179.719 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 51.2 t . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.85 152.39 31.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.15 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -55.25 -23.2 21.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.637 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.1 -39.49 42.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.041 0.536 . . . . 0.0 112.192 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -61.77 2.35 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.135 0.272 . . . . 0.0 111.343 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -63.48 -34.46 77.83 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.209 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -59.91 -57.35 13.26 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 -178.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.6 -41.57 98.32 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.437 ' SD ' HD12 ' A' ' 34' ' ' LEU . 3.5 tpp -61.08 -48.61 80.92 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.892 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -58.21 -39.92 80.28 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.452 0.47 . . . . 0.0 111.214 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -59.58 -59.59 5.19 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.576 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.29 69.29 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.433 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -54.83 -61.2 2.46 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.867 0.365 . . . . 0.0 111.314 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.3 t90 -66.87 -41.96 86.42 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.781 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -59.67 -43.7 93.86 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.211 0.319 . . . . 0.0 111.352 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.27 -47.7 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.35 -26.36 64.98 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.309 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.24 -32.91 70.4 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 123.436 0.46 . . . . 0.0 111.74 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 52' ' ' ASN . 1.1 mt -57.34 138.45 80.88 Favored Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.816 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -90.13 -43.97 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 123.518 2.812 . . . . 0.0 116.516 -176.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -86.8 -2.69 58.77 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -175.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.505 HD11 HD12 ' A' ' 19' ' ' LEU . 89.8 mt -66.9 132.25 47.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.294 -0.962 . . . . 0.0 109.143 178.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.596 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 6.0 m120 -57.0 158.28 5.07 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -56.32 -41.21 75.65 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.797 0.332 . . . . 0.0 111.044 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.69 -41.46 71.95 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.761 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.596 ' NE2' ' H ' ' A' ' 23' ' ' ASN . 26.1 mt-30 -61.22 -42.58 98.85 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.047 -179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.04 -54.41 45.2 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.105 0.478 . . . . 0.0 110.165 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -61.58 -34.69 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.9 71.63 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -60.12 -53.3 59.39 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.471 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.78 -34.06 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.837 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -64.37 -44.48 91.26 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 t -61.5 -31.53 71.53 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.174 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -53.39 -52.07 60.51 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.201 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.6 -39.4 93.63 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.197 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -58.38 -38.62 77.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.999 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.91 105.35 0.72 Allowed Pre-proline 0 CA--C 1.542 0.673 0 O-C-N 123.138 0.274 . . . . 0.0 111.062 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.36 -16.77 56.63 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.836 1.691 . . . . 0.0 111.067 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.2 m -57.57 -33.26 67.97 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.995 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -92.88 -3.05 55.28 Favored 'General case' 0 C--N 1.343 0.292 0 O-C-N 123.192 0.308 . . . . 0.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.6 t -46.01 -38.04 7.34 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.69 73.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -67.88 -47.86 67.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.157 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.439 HD12 HD22 ' A' ' 34' ' ' LEU . 53.3 mt -56.12 -43.73 78.44 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.335 0.397 . . . . 0.0 111.018 -178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.8 tp -61.52 -50.8 71.23 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.223 0.535 . . . . 0.0 109.65 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.04 84.74 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.94 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -62.59 -35.64 80.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.049 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -43.89 97.76 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -62.91 -38.42 90.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.08 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -62.23 -45.09 94.87 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.112 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -44.93 95.35 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.724 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.594 ' HB2' HD13 ' A' ' 19' ' ' LEU . 2.3 t-20 -59.17 -47.05 86.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.333 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.86 -36.79 82.28 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -52.0 27.6 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.278 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.468 ' NE2' HE22 ' A' ' 26' ' ' GLN . 26.9 mt-30 -72.04 -27.41 62.68 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.69 145.12 63.01 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.104 0.252 . . . . 0.0 111.474 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.6 170.0 4.87 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 122.694 2.263 . . . . 0.0 112.007 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp . . . . . 0 CA--C 1.548 0.882 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.673 179.801 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.651 HG22 ' HB3' ' A' ' 4' ' ' LYS . 16.9 m . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.503 ' N ' HG23 ' A' ' 1' ' ' VAL . 48.8 m-20 -63.46 -74.25 0.1 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -90.13 -34.96 15.68 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.651 ' HB3' HG22 ' A' ' 1' ' ' VAL . 0.2 OUTLIER -73.24 -158.23 0.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.576 -178.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -90.73 119.31 30.85 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.231 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -93.31 -38.18 11.64 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.165 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.63 -42.77 75.44 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.813 -178.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -58.32 -38.37 76.99 Favored 'General case' 0 C--O 1.237 0.433 0 O-C-N 123.25 0.344 . . . . 0.0 110.949 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -50.44 67.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.476 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.2 mtm180 -60.26 -37.04 79.2 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.349 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.6 -60.96 2.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.74 -31.63 72.94 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.288 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -56.01 -60.16 3.88 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.882 0.372 . . . . 0.0 111.038 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -68.76 -42.04 78.02 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.706 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -57.63 -46.85 83.62 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.281 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.5 mt -64.18 -45.98 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.65 -25.23 62.53 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.392 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.0 tp -58.17 -37.34 74.53 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.762 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.455 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.2 mm? -72.65 120.24 79.6 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.208 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -89.04 -20.93 1.35 Allowed 'Trans proline' 0 N--CA 1.502 2.019 0 C-N-CA 123.666 2.91 . . . . 0.0 115.523 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.2 p30 -83.78 -2.57 56.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.51 ' HA ' HE22 ' A' ' 55' ' ' GLN . 58.2 mt -73.09 130.4 40.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.516 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.578 ' H ' HE21 ' A' ' 26' ' ' GLN . 44.7 t30 -49.89 147.11 4.04 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.815 0.697 . . . . 0.0 110.526 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -47.72 -43.15 26.69 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -68.9 -44.5 73.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.647 0.261 . . . . 0.0 110.938 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.578 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.7 mt-30 -59.88 -38.23 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.186 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -58.01 -56.05 27.07 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.778 0.323 . . . . 0.0 111.075 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -71.64 -31.95 67.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.775 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.19 66.77 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -61.84 -54.25 44.71 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.0 mt -58.85 -43.05 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 123.041 0.213 . . . . 0.0 111.142 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.61 -45.81 92.5 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.908 0.385 . . . . 0.0 110.145 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 m -60.88 -31.65 71.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.553 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -47.44 83.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.425 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.11 -42.01 99.48 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.75 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.31 -35.2 78.31 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.338 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -144.59 83.64 9.61 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 123.126 0.266 . . . . 0.0 110.739 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.99 -24.6 49.43 Favored 'Trans proline' 0 N--CA 1.5 1.91 0 C-N-CA 122.652 2.235 . . . . 0.0 112.508 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -59.67 -30.67 68.93 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.751 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -96.34 5.09 51.68 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -45.41 -38.57 6.13 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.9 -45.77 73.48 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.806 0.336 . . . . 0.0 110.619 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -67.14 -48.72 67.2 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.482 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.83 -42.65 80.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.172 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.77 -48.97 79.4 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.01 96.98 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.898 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -64.4 -39.76 94.49 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.863 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.19 90.75 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -63.21 -32.86 74.37 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.977 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.19 -46.54 89.39 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.189 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.2 mt -64.45 -38.0 89.49 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.157 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -60.93 -48.5 81.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.872 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.31 -37.58 88.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.147 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.42 -52.3 23.28 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.412 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.51 HE22 ' HA ' ' A' ' 22' ' ' LEU . 22.4 mt-30 -70.17 -27.64 64.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.271 -178.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.86 5.27 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 123.272 0.358 . . . . 0.0 111.718 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.42 156.96 9.99 Favored 'Trans proline' 0 N--CA 1.503 2.048 0 C-N-CA 123.15 2.566 . . . . 0.0 113.13 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.1 mmtp . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.414 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -83.06 -170.09 2.85 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.248 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -55.74 -23.04 26.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.007 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.75 -40.53 6.12 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.389 0.431 . . . . 0.0 111.879 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -55.27 28.61 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.456 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -66.38 -38.66 88.03 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -55.02 -66.71 0.36 Allowed 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.56 -38.1 80.21 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.126 0.266 . . . . 0.0 111.704 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.6 ttm -61.0 -52.49 64.8 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.142 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -59.32 -36.41 75.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 123.273 0.358 . . . . 0.0 111.799 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -60.33 -60.94 3.02 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.116 0.26 . . . . 0.0 111.375 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.83 -28.18 66.5 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.463 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -56.39 -61.61 2.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.886 0.374 . . . . 0.0 111.085 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -67.45 -42.03 83.73 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.187 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -60.2 -46.22 90.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.118 0.261 . . . . 0.0 111.569 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.45 -48.33 85.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 121.061 -0.255 . . . . 0.0 110.372 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.8 65.59 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.424 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.3 tp -58.7 -35.93 73.43 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.447 0.467 . . . . 0.0 111.608 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.79 120.85 64.07 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -87.89 -22.08 1.56 Allowed 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 123.721 2.948 . . . . 0.0 116.403 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.403 HD21 ' ND2' ' A' ' 52' ' ' ASN . 46.4 p-10 -89.37 -0.69 57.67 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -177.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.517 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.3 mt -72.95 138.86 46.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.692 178.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.59 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.9 t-20 -58.25 144.07 42.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.331 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -49.67 -42.69 46.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -68.09 -41.08 82.42 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.095 0.247 . . . . 0.0 111.309 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.59 HE21 ' H ' ' A' ' 23' ' ' ASN . 28.9 mt-30 -63.2 -38.05 89.65 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.157 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -59.17 -60.94 3.06 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.884 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 -62.16 -33.5 74.62 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.117 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.983 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -60.17 -61.48 2.58 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.657 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.455 HD13 ' CD2' ' A' ' 13' ' ' TYR . 54.2 mt -53.44 -43.16 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -61.25 -46.86 88.64 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.206 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.7 m -63.88 -33.7 76.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.61 -44.06 96.74 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.707 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -61.62 -40.72 95.84 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.617 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.66 -37.38 83.84 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.848 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.65 96.6 2.97 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.139 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.69 -16.34 52.34 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.089 1.859 . . . . 0.0 111.395 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.4 m -58.1 -32.63 68.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.822 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -89.12 -3.63 58.58 Favored 'General case' 0 C--O 1.225 -0.184 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.217 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 t -46.96 -39.52 12.55 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.26 -45.13 85.8 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.06 -48.07 66.61 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.285 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.9 mt -58.93 -42.69 90.36 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.234 0.334 . . . . 0.0 110.949 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.18 -48.65 80.85 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.057 0.456 . . . . 0.0 109.816 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.0 -43.4 98.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.7 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -61.08 -36.78 80.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.907 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.64 -44.43 90.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 tttt -61.9 -35.27 77.86 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.783 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -60.5 -45.47 93.66 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.097 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -65.38 -40.74 93.87 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.025 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.403 ' ND2' HD21 ' A' ' 21' ' ' ASN . 14.2 t-20 -60.59 -48.68 80.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.342 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.63 -38.58 90.81 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.397 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.96 -51.44 13.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.517 HE22 ' HA ' ' A' ' 22' ' ' LEU . 20.1 mt-30 -66.43 -27.43 67.83 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.895 -178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.43 142.97 48.79 Favored Pre-proline 0 N--CA 1.47 0.566 0 CA-C-O 120.846 0.355 . . . . 0.0 111.874 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.92 169.36 7.47 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.44 2.093 . . . . 0.0 112.013 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.645 179.207 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.89 -75.08 0.15 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.399 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -90.65 -61.44 1.67 Allowed 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.212 0.32 . . . . 0.0 110.963 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -168.97 142.92 2.97 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.303 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -83.34 45.79 1.07 Allowed 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.222 0.534 . . . . 0.0 111.375 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.531 HD22 ' H ' ' A' ' 6' ' ' ASN . 1.8 p30 -85.12 -1.74 57.22 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -59.86 -46.53 89.01 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-O 120.945 0.403 . . . . 0.0 110.398 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -62.35 -35.27 78.58 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.149 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 58.2 mtt -62.21 -40.65 96.82 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -62.33 -41.83 98.89 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.72 -50.28 71.71 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.035 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.73 -34.93 77.82 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.04 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -55.48 -51.89 65.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.973 0.416 . . . . 0.0 110.802 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -66.04 -45.7 80.47 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.498 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -60.18 -40.7 90.93 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.743 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.68 -55.34 23.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.06 -31.44 65.21 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.458 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -61.71 -37.42 84.09 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.355 0.41 . . . . 0.0 111.153 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -67.58 121.21 78.18 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -87.2 -34.43 0.13 Allowed 'Trans proline' 0 N--CA 1.502 1.981 0 C-N-CA 123.346 2.698 . . . . 0.0 114.817 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.463 HD21 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -61.84 -20.31 63.53 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.134 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.526 ' HA ' HE22 ' A' ' 55' ' ' GLN . 16.5 mt -65.92 127.35 31.68 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.036 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.543 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.0 t-20 -50.18 147.13 4.37 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.072 0.857 . . . . 0.0 110.089 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -50.38 -39.83 47.84 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.53 -41.85 71.99 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.473 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.543 HE21 ' H ' ' A' ' 23' ' ' ASN . 33.4 mt-30 -61.2 -38.48 86.74 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -54.51 -63.51 1.13 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.923 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -61.52 -33.38 73.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.248 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.82 -59.35 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -61.21 -44.77 96.76 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.63 -42.0 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.098 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 46.5 mmm-85 -77.61 -33.73 53.61 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.504 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.4 p -58.13 -31.82 67.56 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.708 -0.224 . . . . 0.0 110.92 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -41.42 86.06 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.708 0.289 . . . . 0.0 110.395 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -65.35 -44.1 88.75 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.579 178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.8 -38.39 81.79 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.556 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.54 88.63 3.95 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.521 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.0 -18.69 64.68 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 122.292 1.995 . . . . 0.0 111.982 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -60.88 -24.53 66.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.482 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.63 6.65 45.63 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.8 m -41.41 -47.44 3.61 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.84 -44.0 86.84 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.087 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -65.56 -44.89 85.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.307 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.8 mt -58.87 -42.55 89.69 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.297 0.373 . . . . 0.0 111.151 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.9 tp -60.82 -47.92 84.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.38 -43.09 99.64 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.669 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -61.75 -37.42 84.21 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.876 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.21 -43.22 92.22 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -63.03 -36.22 82.85 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.652 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.18 -44.07 92.17 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.244 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.02 -43.06 99.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.956 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.463 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -61.07 -47.98 83.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.235 179.027 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.57 -38.83 88.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.221 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.65 -51.33 17.11 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.161 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.526 HE22 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt-30 -65.95 -27.25 68.02 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.878 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.35 145.74 35.6 Favored Pre-proline 0 N--CA 1.472 0.668 0 O-C-N 123.112 0.257 . . . . 0.0 111.597 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -74.78 153.49 42.97 Favored 'Trans proline' 0 N--CA 1.499 1.826 0 C-N-CA 122.858 2.372 . . . . 0.0 112.413 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.488 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -71.56 -72.88 0.2 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.408 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -90.56 -61.49 1.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.932 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -170.33 149.94 3.49 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.241 0.338 . . . . 0.0 110.189 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -81.0 55.88 2.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.576 0.703 . . . . 0.0 111.181 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -64.83 -34.95 79.58 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.217 179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -54.92 -48.68 72.78 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.507 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -62.73 -34.11 76.52 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.8 ttm -61.72 -47.2 86.35 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.198 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.44 -37.12 82.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.776 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -59.1 -54.81 42.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.952 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.38 68.44 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 121.205 -0.198 . . . . 0.0 111.161 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -55.44 -63.87 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.812 0.339 . . . . 0.0 111.271 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.79 -36.78 78.7 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.843 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -58.68 -42.76 89.28 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.184 -0.207 . . . . 0.0 110.92 -179.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 84.5 mt -65.95 -46.92 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -30.16 66.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.314 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.01 -36.2 76.7 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.296 0.372 . . . . 0.0 111.581 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.01 120.32 62.97 Favored Pre-proline 0 CA--C 1.543 0.673 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -88.48 -26.28 0.61 Allowed 'Trans proline' 0 N--CA 1.502 2.008 0 C-N-CA 123.717 2.945 . . . . 0.0 116.327 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 p30 -85.36 -1.78 57.37 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.516 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.2 mt -70.44 139.25 51.73 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.553 ' H ' HE21 ' A' ' 26' ' ' GLN . 21.7 t-20 -55.92 140.67 42.06 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.451 0.469 . . . . 0.0 110.853 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -45.9 -40.08 9.6 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -70.36 -45.07 66.82 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.238 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.553 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.2 mt-30 -60.59 -38.14 83.65 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.129 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mtpp -54.93 -55.84 26.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.476 0.179 . . . . 0.0 111.31 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.3 mtt85 -71.1 -33.31 70.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.216 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.75 -57.9 10.91 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -59.74 -46.0 90.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.23 -39.53 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -67.55 -42.22 83.0 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.881 0.372 . . . . 0.0 110.175 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -60.08 -35.15 74.54 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.035 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.41 -51.31 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 123.356 0.41 . . . . 0.0 110.761 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.85 -42.52 97.56 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.973 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.63 -37.76 85.18 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.674 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -142.17 79.31 16.15 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 123.159 0.287 . . . . 0.0 110.965 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -55.35 -25.09 46.06 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.79 2.327 . . . . 0.0 112.534 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -59.92 -31.27 69.67 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.464 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -91.94 4.11 53.72 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.256 0.347 . . . . 0.0 111.405 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.5 p -40.02 -55.28 2.09 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.78 -39.0 92.85 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.123 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -68.4 -49.21 61.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.48 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.27 -41.42 79.68 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.286 0.366 . . . . 0.0 111.15 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -61.86 -49.7 75.2 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.39 96.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.821 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -63.34 -38.3 90.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.585 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.69 -42.47 95.31 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -63.25 -36.13 82.65 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.584 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -59.73 -44.52 93.74 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.147 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.4 mt -62.92 -42.78 99.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.976 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -60.95 -48.23 82.77 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.338 178.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -62.05 -38.59 89.32 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.435 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.92 -51.46 12.4 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.516 HE22 ' HA ' ' A' ' 22' ' ' LEU . 17.4 mt-30 -66.32 -27.88 68.25 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.75 150.91 24.77 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.179 0.3 . . . . 0.0 111.601 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.67 153.61 69.15 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 122.927 2.418 . . . . 0.0 112.224 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.8 mptt . . . . . 0 C--O 1.221 -0.404 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.4 -179.866 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 60.9 t . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -69.29 -73.19 0.16 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -90.02 -61.23 1.73 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 109.984 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -173.72 152.54 2.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.231 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -80.38 65.79 5.65 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.537 0.684 . . . . 0.0 111.279 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -86.65 -7.02 58.68 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.71 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -61.9 -52.81 62.58 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 120.747 0.308 . . . . 0.0 111.053 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -61.11 -33.99 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.538 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.13 -42.94 99.61 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -62.73 -38.88 92.24 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -63.31 -52.77 60.55 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.131 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.42 74.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.037 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -55.97 -56.06 25.27 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.994 0.426 . . . . 0.0 110.988 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -69.97 -43.37 71.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.657 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -58.45 -47.93 82.38 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.277 0.361 . . . . 0.0 111.476 -178.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 94.4 mt -63.58 -49.64 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.19 -30.47 66.47 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.523 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -60.52 -36.03 77.39 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.86 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.03 120.4 63.73 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.206 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -87.84 -18.22 2.45 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.606 2.871 . . . . 0.0 115.672 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.531 HD21 ' ND2' ' A' ' 52' ' ' ASN . 1.4 p30 -87.83 -5.19 58.73 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -177.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.499 ' HA ' HE22 ' A' ' 55' ' ' GLN . 20.2 mt -74.03 132.08 42.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.792 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.574 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.3 t-20 -54.89 151.5 8.58 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.985 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -54.47 -39.93 67.95 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.78 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -71.65 -45.55 61.65 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.068 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.574 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.5 mt-30 -61.26 -45.15 95.69 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.071 -178.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.05 -52.18 66.46 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.174 0.296 . . . . 0.0 111.11 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -66.21 -33.84 76.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.271 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.77 96.73 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.18 -0.463 . . . . 0.0 112.172 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -61.29 -62.07 2.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.8 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.5 mt -56.21 -41.85 71.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 123.119 0.262 . . . . 0.0 111.527 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -62.79 -51.01 68.78 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-O 120.964 0.411 . . . . 0.0 110.306 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 89.5 p -64.05 -23.9 67.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.245 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -46.51 89.68 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -64.3 -44.47 91.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.371 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -61.41 -38.27 86.48 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.303 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -135.59 81.54 41.6 Favored Pre-proline 0 CA--C 1.549 0.909 0 O-C-N 123.398 0.436 . . . . 0.0 110.347 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -63.18 -17.46 60.25 Favored 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 121.909 1.739 . . . . 0.0 112.461 -179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.7 p -65.2 -26.59 68.2 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.23 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -101.96 4.44 39.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.7 m -45.05 -38.91 5.26 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.31 -45.98 74.9 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.702 0.286 . . . . 0.0 110.346 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.68 -46.06 80.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.7 -41.24 81.3 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.336 0.397 . . . . 0.0 111.014 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.9 tp -61.08 -49.02 79.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.9 99.56 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.821 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -61.37 -39.31 90.17 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.841 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.46 97.42 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -65.3 -35.67 81.72 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.711 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -59.39 -47.35 85.77 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.54 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -63.66 -38.16 90.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.19 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.531 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.77 -48.67 78.14 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.869 178.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.21 -38.54 89.55 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.14 -51.25 18.63 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.092 -178.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.499 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.7 mt-30 -66.29 -26.18 67.2 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.912 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.31 145.9 34.49 Favored Pre-proline 0 N--CA 1.471 0.611 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.16 153.5 46.29 Favored 'Trans proline' 0 N--CA 1.498 1.78 0 C-N-CA 122.926 2.417 . . . . 0.0 112.376 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 89.7 mttt . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.524 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -75.12 0.09 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -89.89 -60.93 1.8 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -173.02 152.64 2.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.172 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 15.0 p90 -79.23 58.65 2.59 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.488 0.661 . . . . 0.0 112.099 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.95 -29.81 65.93 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.204 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -56.32 -43.87 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.252 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.99 -40.13 92.32 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.4 mtt -64.4 -38.68 91.87 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.163 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -59.76 -40.0 86.69 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.308 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -64.33 -54.99 24.39 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.53 -34.0 76.82 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.933 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CE2' HD13 ' A' ' 31' ' ' ILE . 35.6 t80 -57.88 -57.55 12.3 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.856 0.36 . . . . 0.0 111.439 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -68.99 -44.95 71.82 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.436 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -59.44 -46.4 88.84 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.606 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.55 -42.85 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.296 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.22 -32.57 70.08 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.084 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.54 -33.76 76.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.719 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -61.99 119.12 45.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 122.958 0.161 . . . . 0.0 111.115 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -89.59 -42.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 123.583 2.855 . . . . 0.0 114.796 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.86 -36.82 75.22 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.6 HD11 ' HA ' ' A' ' 52' ' ' ASN . 8.6 mp -63.62 130.43 44.25 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.601 -0.439 . . . . 0.0 110.326 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.467 ' H ' HE21 ' A' ' 26' ' ' GLN . 62.7 t30 -51.12 146.94 5.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.407 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -53.78 -38.07 64.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.652 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.64 -43.04 99.81 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.364 0.415 . . . . 0.0 110.457 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.467 HE21 ' H ' ' A' ' 23' ' ' ASN . 34.6 mt-30 -65.65 -43.48 89.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.361 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -62.68 -50.93 69.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.578 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -62.06 -40.97 97.59 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.681 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.61 -34.46 77.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.791 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -63.41 -59.07 5.16 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.175 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.534 HD13 ' CE2' ' A' ' 13' ' ' TYR . 63.6 mt -61.74 -32.99 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.704 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.09 -46.36 71.2 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.216 0.532 . . . . 0.0 109.683 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 96.5 p -64.99 -21.93 66.92 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.993 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.461 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -59.62 -48.64 80.86 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -66.35 -41.8 89.02 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.716 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.76 -36.82 84.29 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.385 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -147.66 78.6 9.86 Favored Pre-proline 0 CA--C 1.542 0.637 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.228 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.61 -27.73 85.35 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.544 2.163 . . . . 0.0 112.437 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.2 m -58.99 -30.34 67.9 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.703 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.8 5.76 44.68 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.5 t -45.51 -38.09 5.97 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.3 0.5 . . . . 0.0 111.777 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.06 -46.52 70.84 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.319 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -66.88 -45.84 76.83 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 34' ' ' LEU . 97.7 mt -57.11 -41.66 79.39 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.546 0.529 . . . . 0.0 110.99 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.72 -49.21 75.97 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.59 81.97 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.839 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -62.5 -32.88 73.87 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.488 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.13 -41.75 90.04 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -61.44 -35.21 76.96 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.891 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.42 -51.31 66.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.03 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 51' ' ' LEU . 89.1 mt -63.51 -39.46 94.49 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.045 179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.6 ' HA ' HD11 ' A' ' 22' ' ' LEU . 20.0 t-20 -56.64 -47.93 78.63 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.08 -31.88 72.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.389 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -53.12 34.69 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.452 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.8 mt-30 -80.89 -26.24 36.97 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.73 157.17 8.06 Favored Pre-proline 0 N--CA 1.472 0.667 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.94 159.05 4.13 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 123.0 2.467 . . . . 0.0 112.464 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt . . . . . 0 CA--C 1.546 0.819 0 CA-C-O 118.585 -0.721 . . . . 0.0 111.604 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.46 -71.06 0.19 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.018 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -90.06 -61.61 1.65 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.314 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -174.25 148.62 1.31 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.351 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -83.54 48.25 1.39 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.311 0.577 . . . . 0.0 111.314 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.476 HD22 ' H ' ' A' ' 6' ' ' ASN . 2.2 p30 -84.84 -2.05 57.25 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.993 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -60.19 -48.19 82.76 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.966 0.413 . . . . 0.0 110.348 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.87 -35.03 77.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.319 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 59.9 mtt -62.04 -41.55 98.24 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.246 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -62.33 -42.94 99.79 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.348 0.405 . . . . 0.0 109.926 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -61.92 -50.3 72.71 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.35 -31.77 71.4 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.017 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -56.19 -56.62 18.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.819 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.73 -41.28 79.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.176 -0.466 . . . . 0.0 112.069 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -58.67 -42.88 89.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 121.176 -0.209 . . . . 0.0 111.451 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 83.3 mt -65.32 -52.2 55.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.98 68.1 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.402 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.2 tp -60.59 -36.48 78.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.598 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.12 119.67 71.6 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -88.18 -24.22 1.02 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 123.651 2.901 . . . . 0.0 115.69 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.551 HD21 ' ND2' ' A' ' 52' ' ' ASN . 2.0 p30 -80.6 -6.3 58.09 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.526 ' HA ' HE22 ' A' ' 55' ' ' GLN . 22.6 mt -71.7 132.2 44.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.941 -0.703 . . . . 0.0 109.202 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.573 ' H ' HE21 ' A' ' 26' ' ' GLN . 64.2 t30 -51.73 151.96 3.11 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 123.712 0.633 . . . . 0.0 110.926 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -50.95 -40.79 58.26 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -74.93 -48.04 26.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.849 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.573 HE21 ' H ' ' A' ' 23' ' ' ASN . 26.2 mt-30 -59.73 -45.7 91.4 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.226 -178.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 ttmm -56.59 -47.36 79.74 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.287 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -79.54 -32.13 42.14 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.873 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -45.56 91.54 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -59.24 -58.63 7.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.544 -0.462 . . . . 0.0 112.054 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -54.94 -46.05 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 O-C-N 123.094 0.246 . . . . 0.0 111.557 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -62.88 -47.24 84.16 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.767 0.318 . . . . 0.0 110.547 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -61.22 -30.61 70.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.002 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -44.89 92.58 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.07 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -64.24 -39.53 94.14 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.575 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -67.14 -38.45 85.57 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.706 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -140.06 74.82 30.35 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.225 0.328 . . . . 0.0 110.454 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.87 -16.41 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 112.428 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.2 m -61.48 -29.71 70.14 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.15 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.464 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 51.2 mm-40 -105.06 9.71 34.27 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.8 m -44.29 -35.08 2.16 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.66 -51.21 69.39 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.204 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.464 ' ND2' ' HB3' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -71.0 -37.03 72.66 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.24 -178.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.08 -44.46 96.63 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.64 -48.43 81.81 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.74 91.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.846 178.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -63.72 -37.24 86.61 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.806 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.31 93.81 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -63.5 -35.65 81.17 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.943 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -59.13 -47.99 83.26 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.571 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.32 -38.84 92.72 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.174 179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.551 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.6 OUTLIER -62.52 -48.26 80.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.885 178.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.46 -38.48 89.99 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.086 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.28 -51.26 15.8 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.526 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.2 mt-30 -65.37 -26.84 68.19 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.37 157.31 4.97 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.15 0.281 . . . . 0.0 111.672 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -51.2 156.51 5.27 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 123.101 2.534 . . . . 0.0 112.954 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.883 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 2' ' ' ASP . 17.7 t . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.453 ' N ' HG12 ' A' ' 1' ' ' VAL . 11.1 t70 -62.7 138.55 58.54 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -54.21 -23.21 13.76 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.613 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -25.36 17.42 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -85.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -52.04 -35.73 48.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.14 -67.08 0.42 Allowed 'General case' 0 C--O 1.24 0.574 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -61.1 -39.26 89.27 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.498 ' SD ' ' CD2' ' A' ' 34' ' ' LEU . 1.6 mmm -62.8 -43.27 99.23 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.932 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -60.18 -40.11 88.84 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.293 0.37 . . . . 0.0 110.571 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -59.64 -55.85 29.26 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.305 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.68 -29.99 66.44 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 31' ' ' ILE . 44.7 t80 -57.24 -59.67 4.76 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.867 0.365 . . . . 0.0 111.179 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -67.85 -42.55 81.22 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.121 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.25 -46.44 89.79 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.129 0.268 . . . . 0.0 111.52 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.48 -47.44 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.274 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.4 -29.38 66.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.533 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -59.88 -36.73 77.54 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 123.264 0.352 . . . . 0.0 111.471 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 120.98 69.4 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -86.88 -34.44 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.258 2.639 . . . . 0.0 114.652 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.49 HD21 ' ND2' ' A' ' 52' ' ' ASN . 0.2 OUTLIER -64.42 -19.29 65.43 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -177.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HA ' HE22 ' A' ' 55' ' ' GLN . 13.1 mt -64.0 132.1 49.6 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.938 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.539 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.7 t-20 -55.58 143.18 30.75 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -50.23 -39.14 43.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -67.03 -43.95 81.48 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.86 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.539 HE21 ' H ' ' A' ' 23' ' ' ASN . 32.7 mt-30 -62.5 -36.96 84.17 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.883 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -59.31 -62.94 1.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 110.694 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -60.29 -34.94 74.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.15 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.15 -48.45 81.56 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.412 0.445 . . . . 0.0 111.986 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.56 -61.43 2.59 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.253 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.46 HD13 ' CD2' ' A' ' 13' ' ' TYR . 51.4 mt -54.51 -39.42 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 O-C-N 123.336 0.397 . . . . 0.0 111.963 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.84 -50.49 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.7 m -63.53 -34.93 78.87 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.829 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' CD2' ' SD ' ' A' ' 9' ' ' MET . 3.9 tt -59.11 -42.22 90.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.955 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -63.11 -45.42 92.09 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.53 -36.76 85.25 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.452 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -139.14 82.0 20.21 Favored Pre-proline 0 CA--C 1.545 0.761 0 O-C-N 123.334 0.396 . . . . 0.0 111.521 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.7 -17.38 49.26 Favored 'Trans proline' 0 N--CA 1.505 2.149 0 C-N-CA 122.499 2.132 . . . . 0.0 111.993 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.7 m -57.26 -33.78 67.96 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.288 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -91.62 -0.59 57.59 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 123.187 0.304 . . . . 0.0 111.521 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.6 t -46.11 -37.78 7.28 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 117.694 0.224 . . . . 0.0 111.579 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -45.51 70.5 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -66.82 -47.27 72.53 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.051 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.52 -40.45 82.93 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.305 0.378 . . . . 0.0 110.752 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 15.4 tp -61.02 -49.04 79.01 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.703 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -61.44 -38.16 86.15 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.655 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.1 96.43 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 tttt -64.52 -37.57 88.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.161 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -60.65 -44.3 96.59 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.794 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 51' ' ' LEU . 78.1 mt -62.45 -44.57 96.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.508 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.49 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -59.5 -48.14 82.79 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.401 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.25 -37.95 84.95 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.036 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.01 17.42 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.954 -178.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.522 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.1 mt-30 -65.34 -27.25 68.46 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.894 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -52.92 151.76 8.11 Favored Pre-proline 0 N--CA 1.475 0.777 0 O-C-N 123.213 0.321 . . . . 0.0 111.835 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.4 170.41 4.22 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.742 2.294 . . . . 0.0 112.152 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.7 mttt . . . . . 0 N--CA 1.477 0.913 0 O-C-N 124.285 0.991 . . . . 0.0 110.778 179.96 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 40.9 t . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -71.63 -74.1 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.489 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -90.31 -61.29 1.71 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.245 0.341 . . . . 0.0 110.801 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -169.32 146.4 3.49 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.097 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -80.02 71.0 6.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.48 0.657 . . . . 0.0 111.127 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -88.26 -5.44 58.36 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.6 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -62.23 -51.13 68.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.73 0.3 . . . . 0.0 110.798 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -61.25 -34.13 74.65 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.67 -42.92 99.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.432 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.44 -38.74 92.3 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -63.59 -53.89 44.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.766 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -31.83 72.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.057 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -56.72 -56.11 25.56 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.02 0.438 . . . . 0.0 110.594 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -68.38 -44.58 74.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.588 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.35 -42.05 94.9 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.0 mt -65.01 -49.78 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.37 -25.13 61.69 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.17 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.02 -37.68 74.77 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.356 0.41 . . . . 0.0 111.98 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.6 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.9 mm? -69.93 119.9 74.44 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -89.01 -20.73 1.39 Allowed 'Trans proline' 0 N--CA 1.5 1.899 0 C-N-CA 123.208 2.605 . . . . 0.0 115.134 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 p30 -86.97 -2.57 58.72 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.736 HD23 HE22 ' A' ' 55' ' ' GLN . 39.8 mt -71.36 135.13 47.16 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.387 178.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.54 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.5 t-20 -51.33 143.64 11.13 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.586 0.554 . . . . 0.0 110.095 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -47.97 -39.96 20.99 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.403 0.439 . . . . 0.0 112.152 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -68.65 -44.4 74.19 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.023 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.54 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.5 mt-30 -62.68 -36.95 84.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.111 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -57.55 -56.78 17.43 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.666 0.269 . . . . 0.0 110.973 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -68.71 -34.53 75.8 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.182 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.61 -52.41 63.89 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -59.45 -61.25 2.76 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 120.422 -0.511 . . . . 0.0 112.118 -178.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.7 -41.67 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.188 0.305 . . . . 0.0 111.657 -178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.0 ttt-85 -63.28 -49.28 74.68 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.924 0.392 . . . . 0.0 110.175 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 57.1 m -61.19 -30.22 70.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.024 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.14 -43.86 92.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.061 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -66.17 -41.95 89.6 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.011 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -43.11 88.41 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.876 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -135.94 74.51 57.03 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.018 0.437 . . . . 0.0 110.638 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -60.68 -11.03 15.75 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.486 2.124 . . . . 0.0 113.11 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.4 p -62.02 -25.08 67.45 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.83 16.81 19.4 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -48.56 -37.24 17.32 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.86 -45.23 90.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.425 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -64.3 -47.17 80.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.113 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.81 -41.86 78.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.408 0.443 . . . . 0.0 111.267 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.56 -49.99 75.34 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.03 99.74 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.764 178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -59.92 -38.08 81.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.864 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.27 -47.76 81.01 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -62.53 -37.78 87.43 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.336 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -60.2 -45.29 93.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.272 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 mt -64.87 -39.8 94.13 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -60.02 -49.1 79.0 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.429 0.456 . . . . 0.0 110.307 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.63 -38.87 89.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.265 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.51 -51.37 14.93 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.736 HE22 HD23 ' A' ' 22' ' ' LEU . 19.1 mt-30 -65.45 -27.94 68.87 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.614 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.34 145.0 59.96 Favored Pre-proline 0 CA--C 1.537 0.469 0 O-C-N 123.288 0.367 . . . . 0.0 111.467 -179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.47 151.62 47.92 Favored 'Trans proline' 0 N--CA 1.496 1.667 0 C-N-CA 122.923 2.415 . . . . 0.0 112.261 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt . . . . . 0 C--O 1.223 -0.329 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.408 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.86 -79.78 0.05 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.265 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -89.73 -60.96 1.8 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.09 0.244 . . . . 0.0 110.636 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -172.11 146.36 1.92 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.102 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -81.33 51.77 1.69 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.458 0.647 . . . . 0.0 111.044 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -56.28 -29.23 60.89 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.562 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.0 -35.31 64.23 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.511 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.569 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -40.84 97.36 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.507 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -58.49 -41.29 84.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.457 0.473 . . . . 0.0 110.806 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -63.22 -54.97 29.07 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.146 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.55 78.24 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.291 -179.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -55.89 -53.01 61.94 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.904 0.383 . . . . 0.0 111.153 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 46.4 t90 -67.54 -46.38 72.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.219 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.41 -43.5 96.65 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.846 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 93.2 mt -64.74 -48.96 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.95 -31.34 68.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.304 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.51 -35.96 77.2 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.295 0.372 . . . . 0.0 111.531 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -67.67 120.24 71.95 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -88.62 -26.92 0.49 Allowed 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 123.663 2.908 . . . . 0.0 116.297 -178.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 p-10 -83.71 -0.66 51.74 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -176.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.522 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.0 mt -72.28 135.21 45.92 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.319 178.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.542 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.4 t-20 -54.11 142.84 24.15 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.654 0.596 . . . . 0.0 110.234 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -47.6 -42.63 24.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -66.61 -41.47 88.34 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.287 0.367 . . . . 0.0 111.383 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.542 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.5 mt-30 -64.98 -41.36 95.51 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.063 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -52.99 -54.38 35.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.717 0.294 . . . . 0.0 111.172 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -71.43 -36.05 71.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.401 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.83 -55.37 36.03 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -60.25 -54.13 49.4 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.9 mt -58.22 -41.1 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.188 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -64.81 -48.03 75.88 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.04 0.447 . . . . 0.0 109.999 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.2 t -61.81 -24.99 67.22 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.361 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.14 -43.94 98.11 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.649 0.593 . . . . 0.0 109.52 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -67.18 -39.9 86.5 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -64.6 -30.63 71.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.339 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -144.74 76.62 13.96 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 120.771 0.319 . . . . 0.0 110.683 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -54.42 -31.41 68.27 Favored 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.987 2.458 . . . . 0.0 112.698 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -59.36 -28.45 66.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.203 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -92.74 1.88 57.04 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.2 t -44.02 -41.66 5.57 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.69 -46.0 76.99 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.667 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -67.18 -46.11 74.95 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.181 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -57.73 -43.45 85.34 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.159 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.7 tp -60.92 -49.87 75.72 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.38 97.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.804 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -62.57 -39.02 92.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.348 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -40.95 97.13 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -63.81 -36.38 83.71 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.586 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -59.81 -44.31 94.05 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.15 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.54 -43.09 99.67 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.1 178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.24 -48.38 81.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.29 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -61.76 -38.42 87.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.494 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.47 -51.55 11.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.522 HE22 ' HA ' ' A' ' 22' ' ' LEU . 19.5 mt-30 -65.8 -27.92 68.63 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 146.04 56.64 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 123.166 0.291 . . . . 0.0 111.485 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.82 153.76 58.77 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.997 2.465 . . . . 0.0 112.22 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mttp . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 118.099 -0.953 . . . . 0.0 110.484 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.466 HG22 ' N ' ' A' ' 2' ' ' ASP . 12.7 p . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.466 ' N ' HG22 ' A' ' 1' ' ' VAL . 18.0 t70 -63.5 148.7 47.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.097 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -54.67 -22.38 13.55 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.528 -179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -24.63 17.06 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.447 ' CD2' ' CE ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -63.91 -62.55 1.57 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.518 0.199 . . . . 0.0 111.529 -179.135 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -58.65 -36.43 74.12 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.71 -55.28 37.09 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.98 -43.19 99.47 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.362 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.667 ' SD ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -63.17 -44.72 94.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.967 -179.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -57.68 -41.43 81.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.318 0.387 . . . . 0.0 111.05 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -61.01 -57.14 13.87 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.465 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -30.33 68.29 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.456 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CD2' HD13 ' A' ' 31' ' ' ILE . 42.0 t80 -56.37 -58.99 5.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.895 0.379 . . . . 0.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -65.74 -43.26 89.49 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.652 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -59.91 -50.75 72.56 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.186 0.303 . . . . 0.0 111.27 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 89.7 mt -63.57 -47.08 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 120.575 0.226 . . . . 0.0 110.484 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.41 -29.42 64.11 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.64 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -60.65 -36.98 80.04 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.241 0.338 . . . . 0.0 111.641 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.32 120.02 61.31 Favored Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -88.85 -26.18 0.55 Allowed 'Trans proline' 0 N--CA 1.503 2.038 0 C-N-CA 123.696 2.931 . . . . 0.0 116.28 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -84.62 -0.44 53.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.528 ' HA ' HE22 ' A' ' 55' ' ' GLN . 19.6 mt -72.84 135.65 45.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 120.209 -0.596 . . . . 0.0 109.579 178.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.532 ' H ' HE21 ' A' ' 26' ' ' GLN . 24.9 t-20 -53.89 143.52 21.15 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.698 0.624 . . . . 0.0 110.136 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -47.85 -40.74 22.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -68.8 -43.13 76.26 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.684 0.278 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.532 HE21 ' H ' ' A' ' 23' ' ' ASN . 27.6 mt-30 -63.81 -37.73 88.48 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.273 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -56.36 -55.07 38.03 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.733 0.302 . . . . 0.0 111.279 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm180 -72.21 -31.9 66.27 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.494 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.1 -50.34 73.1 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -61.4 -55.41 31.8 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 13' ' ' TYR . 49.2 mt -56.79 -38.34 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 122.966 0.166 . . . . 0.0 111.31 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 mmm-85 -65.94 -42.29 90.24 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.5 t -61.89 -30.58 70.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.084 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.667 HD12 ' SD ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -53.51 -51.07 63.99 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.781 179.577 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.27 -39.51 94.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.204 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -56.98 -38.08 72.52 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.599 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.92 104.62 1.15 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 121.165 -0.214 . . . . 0.0 111.19 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.18 -17.39 59.54 Favored 'Trans proline' 0 N--CA 1.502 1.971 0 C-N-CA 121.898 1.732 . . . . 0.0 111.69 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.3 p -59.52 -30.71 68.77 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -96.39 1.14 51.49 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.124 0.265 . . . . 0.0 111.461 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.3 p -43.7 -51.82 6.88 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.54 91.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.744 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -69.11 -49.06 60.5 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.295 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.2 mt -56.72 -45.09 82.09 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.495 0.497 . . . . 0.0 110.923 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.99 -52.21 66.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.27 86.68 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.056 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -62.54 -37.72 87.22 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.261 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.52 -42.64 95.65 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -63.54 -35.47 80.58 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.783 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -59.64 -47.14 86.77 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.342 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.9 mt -63.36 -39.74 95.36 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.335 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -61.3 -48.43 81.43 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.316 0.385 . . . . 0.0 110.114 178.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -62.4 -38.68 90.6 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.312 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.34 -51.56 12.88 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.528 HE22 ' HA ' ' A' ' 22' ' ' LEU . 18.7 mt-30 -66.35 -27.93 68.27 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.23 146.44 61.97 Favored Pre-proline 0 CA--C 1.537 0.466 0 O-C-N 123.206 0.316 . . . . 0.0 111.327 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.18 158.8 55.16 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.846 2.364 . . . . 0.0 111.989 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt . . . . . 0 CA--C 1.541 0.609 0 O-C-N 124.059 0.85 . . . . 0.0 110.923 -179.975 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 44.4 t . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -71.13 -72.32 0.22 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.56 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -90.42 -61.5 1.67 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.213 0.32 . . . . 0.0 111.075 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -171.25 149.43 2.8 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.185 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -82.88 52.3 2.12 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.523 0.678 . . . . 0.0 111.349 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -59.22 -30.8 68.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.312 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -55.32 -34.6 64.31 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.333 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.28 -44.22 97.59 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.361 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -38.73 92.22 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -59.21 -39.22 81.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.63 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -65.26 -55.24 19.54 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.057 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.8 -34.96 79.07 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.949 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -56.57 -52.95 62.88 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.214 0.531 . . . . 0.0 110.625 179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -62.53 -46.01 90.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.775 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -61.09 -42.31 98.27 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -178.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.3 mt -62.34 -53.86 41.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 120.638 0.256 . . . . 0.0 110.421 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.83 -30.58 67.76 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.542 -179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -60.37 -37.14 79.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 123.242 0.339 . . . . 0.0 111.203 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.65 120.8 68.92 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.14 -21.6 1.57 Allowed 'Trans proline' 0 N--CA 1.504 2.134 0 C-N-CA 123.824 3.016 . . . . 0.0 116.236 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -89.85 -0.15 57.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -176.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' HA ' HE22 ' A' ' 55' ' ' GLN . 23.8 mt -74.89 138.37 42.39 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.85 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.579 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.3 t-20 -60.94 145.93 48.65 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.834 178.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -51.38 -42.38 61.35 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.06 -37.95 81.86 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.221 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.579 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.3 mt-30 -67.32 -53.96 24.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 28' ' ' ARG . 1.5 ptpm? -56.34 -48.58 76.49 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.68 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.419 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 77.9 mtt85 -63.25 -33.44 75.51 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.763 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.66 -55.64 16.42 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -60.0 -41.2 91.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.146 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 mm -57.05 -42.3 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -72.55 -35.69 68.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.194 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -57.51 -33.66 68.29 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.508 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 34' ' ' LEU . 2.8 mm? -51.72 -53.6 37.58 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.168 0.292 . . . . 0.0 110.368 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.16 -39.69 95.39 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.051 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.26 -40.86 95.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.503 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -151.31 82.92 5.63 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 123.243 0.339 . . . . 0.0 110.332 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.76 -24.97 80.18 Favored 'Trans proline' 0 N--CA 1.501 1.941 0 C-N-CA 122.411 2.074 . . . . 0.0 112.13 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -59.6 -33.15 71.1 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.172 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -88.76 8.69 27.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.439 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 33.3 p -43.35 -48.74 6.97 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.94 95.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.696 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.35 -47.26 61.84 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.294 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 77.3 mt -58.14 -43.97 87.6 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.314 0.384 . . . . 0.0 110.857 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 tp -60.78 -49.08 78.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.14 -41.92 97.6 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.881 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -62.89 -37.69 87.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.824 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.27 90.75 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 tttt -63.17 -36.31 83.21 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.624 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -58.54 -43.7 89.36 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.352 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 51' ' ' LEU . 75.6 mt -63.11 -41.98 99.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.988 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -62.68 -47.81 82.05 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.326 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -61.76 -37.86 85.85 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.348 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.78 -50.69 14.49 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.502 HE22 ' HA ' ' A' ' 22' ' ' LEU . 23.0 mt-30 -67.88 -27.46 66.68 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 -178.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 158.48 5.58 Favored Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.19 155.8 11.36 Favored 'Trans proline' 0 N--CA 1.503 2.055 0 C-N-CA 123.151 2.567 . . . . 0.0 112.993 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.3 mptt . . . . . 0 CA--C 1.534 0.357 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.414 -179.871 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -67.58 -65.83 0.64 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.21 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -91.3 -60.55 1.86 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 mttp 179.65 158.11 0.66 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.265 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -84.97 43.63 1.01 Allowed 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.378 0.609 . . . . 0.0 111.301 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -63.62 -37.44 87.35 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.538 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -53.61 -49.48 67.74 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.077 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -61.97 -41.82 98.44 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.742 -179.6 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.411 ' SD ' ' HB3' ' A' ' 38' ' ' PRO . 73.7 mtm -64.26 -37.05 86.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.878 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -61.04 -39.8 91.19 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -61.75 -43.47 98.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.953 179.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.05 -40.13 87.05 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.259 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -48.93 76.94 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.566 179.908 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -61.37 -44.41 97.21 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -61.36 -39.93 92.45 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 82.0 mt -60.97 -52.77 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.279 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.31 -31.42 67.49 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.424 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.99 -35.76 77.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.573 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -70.26 121.71 84.05 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.495 -179.282 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -87.34 -22.81 1.59 Allowed 'Trans proline' 0 N--CA 1.507 2.268 0 C-N-CA 123.823 3.015 . . . . 0.0 115.259 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.95 79.98 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -177.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.692 HD12 ' H ' ' A' ' 22' ' ' LEU . 4.1 mp -73.01 132.31 43.23 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.977 0.417 . . . . 0.0 111.025 -178.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' H ' HE21 ' A' ' 26' ' ' GLN . 0.2 OUTLIER -55.36 156.98 3.97 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.101 179.857 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -57.07 -42.13 80.04 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.305 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -43.92 96.1 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.859 -179.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.531 HE21 ' H ' ' A' ' 23' ' ' ASN . 35.4 mt-30 -62.99 -39.06 93.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.71 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -58.4 -64.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.935 -179.384 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -59.58 -34.22 72.44 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.721 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.24 -43.77 95.79 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.281 0.363 . . . . 0.0 111.53 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -63.54 -52.52 60.77 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.93 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.0 mm -56.41 -46.03 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -61.49 -47.79 84.03 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 120.679 0.276 . . . . 0.0 110.358 179.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.8 t -62.34 -30.46 71.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.246 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.18 -51.47 69.6 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.449 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -62.28 -40.52 96.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.678 179.086 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.77 -40.05 93.81 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.116 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -136.76 82.89 31.01 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.668 -179.357 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.411 ' HB3' ' SD ' ' A' ' 9' ' ' MET . 51.7 Cg_exo -53.49 -28.23 44.01 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.869 2.379 . . . . 0.0 112.424 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.5 -35.01 73.32 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.008 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -82.66 -1.47 51.21 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.0 p -41.31 -54.43 3.0 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.74 92.35 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -67.95 -50.22 57.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.745 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -57.05 -40.76 77.43 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 123.091 0.244 . . . . 0.0 111.15 -178.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.4 tp -61.49 -50.3 73.29 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.732 179.164 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.18 89.83 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.824 178.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -62.19 -36.5 82.1 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.58 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.58 -39.66 91.85 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -63.68 -39.65 94.84 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.609 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.83 -51.89 66.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.37 -36.3 83.57 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.458 ' HB2' HD11 ' A' ' 22' ' ' LEU . 0.8 OUTLIER -60.96 -49.11 78.79 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.371 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -63.68 -37.03 85.79 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.729 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.7 -52.25 13.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -177.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.461 HE22 ' HA ' ' A' ' 22' ' ' LEU . 14.5 mt-30 -68.31 -25.88 65.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 -179.052 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.52 149.45 39.79 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 123.06 0.225 . . . . 0.0 111.085 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.93 155.01 62.85 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 122.776 2.318 . . . . 0.0 112.272 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? . . . . . 0 N--CA 1.476 0.83 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.865 179.921 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.02 -40.12 72.95 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.44 -179.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.43 -41.78 90.34 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.666 0.269 . . . . 0.0 110.7 179.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 tttp -69.35 -51.75 33.89 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.945 179.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -24.69 67.72 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -91.74 -61.51 1.62 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.97 -47.42 83.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -57.96 -46.49 85.01 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 120.803 0.335 . . . . 0.0 111.115 -178.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -50.3 72.32 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.48 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -55.78 -41.55 74.22 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 123.569 0.543 . . . . 0.0 111.61 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -58.42 -61.89 2.25 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.501 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.29 -23.52 64.76 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.294 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -58.71 -58.93 6.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 111.394 0.146 . . . . 0.0 111.394 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . 0.449 ' CD1' ' C ' ' A' ' 14' ' ' TRP . 0.4 OUTLIER -73.58 -35.45 65.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.515 -178.937 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.68 -47.46 85.55 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.198 0.311 . . . . 0.0 110.793 -179.286 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.427 HG23 ' HB1' ' A' ' 48' ' ' ALA . 96.7 mt -68.58 -49.92 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.832 179.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.0 -24.94 42.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.773 -178.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.1 tp -56.7 -39.03 73.12 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.359 0.412 . . . . 0.0 111.899 -179.044 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.477 HD22 ' H ' ' A' ' 19' ' ' LEU . 1.1 mm? -68.73 120.89 78.83 Favored Pre-proline 0 CA--C 1.543 0.7 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -89.19 -9.94 4.18 Favored 'Trans proline' 0 N--CA 1.504 2.119 0 C-N-CA 123.597 2.865 . . . . 0.0 115.671 -178.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.4 p30 -95.84 -1.43 49.53 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.492 ' HA ' HE22 ' A' ' 55' ' ' GLN . 29.2 mt -75.25 130.36 38.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.69 178.759 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.524 ' H ' HE21 ' A' ' 26' ' ' GLN . 22.8 t-20 -53.89 148.12 10.96 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.628 0.58 . . . . 0.0 109.612 179.158 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -53.05 -44.0 67.07 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -65.54 -42.17 92.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.177 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.524 HE21 ' H ' ' A' ' 23' ' ' ASN . 30.0 mt-30 -65.22 -48.2 74.18 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.303 -179.428 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -61.34 -49.13 78.2 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 123.303 0.377 . . . . 0.0 110.688 -179.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -61.74 -39.51 91.84 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.641 179.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.03 -44.44 95.92 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.156 -179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -60.31 -56.93 15.53 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.649 -179.145 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.1 mt -57.89 -44.19 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 123.162 0.289 . . . . 0.0 110.978 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 72.7 ttt-85 -62.17 -50.02 73.5 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.843 0.354 . . . . 0.0 110.616 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 t -58.15 -29.31 65.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -45.61 91.46 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -64.12 -39.74 94.68 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.368 178.686 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -59.81 -36.29 76.47 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.05 92.68 2.58 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.82 -179.843 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.98 -18.68 51.63 Favored 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.381 2.054 . . . . 0.0 111.901 179.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.1 p -59.43 -25.32 64.24 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.811 -179.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -102.26 0.87 35.07 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.3 m -46.1 -39.74 9.86 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.78 84.1 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -67.3 -48.05 68.78 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.28 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.1 mt -57.46 -43.01 83.65 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.233 0.333 . . . . 0.0 111.056 -179.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.0 -50.96 71.69 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.26 0.553 . . . . 0.0 109.687 179.083 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.0 -41.33 96.32 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.04 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -63.72 -38.12 89.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.776 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.427 ' HB1' HG23 ' A' ' 16' ' ' ILE . . . -63.62 -44.69 93.19 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -63.49 -32.96 74.55 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.05 179.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -60.27 -47.47 85.85 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.953 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.8 mt -63.82 -37.11 86.15 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.004 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -62.66 -48.77 77.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.988 178.928 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.52 -38.75 91.18 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.88 -51.58 15.74 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.161 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.492 HE22 ' HA ' ' A' ' 22' ' ' LEU . 25.4 mt-30 -66.5 -27.5 67.83 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.067 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.48 145.44 48.74 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 123.237 0.335 . . . . 0.0 111.588 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.28 154.71 41.41 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 123.084 2.523 . . . . 0.0 112.476 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.392 179.805 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -73.74 -74.52 0.18 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.386 -179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -89.93 -60.99 1.79 Allowed 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.255 0.347 . . . . 0.0 110.583 179.856 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -173.1 151.86 2.19 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -83.24 56.26 3.46 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 110.867 179.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -59.88 -28.12 67.27 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.629 179.747 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -55.16 -37.49 67.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.589 -178.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -62.95 -40.03 96.42 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.669 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -39.36 93.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.555 179.308 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -59.28 -43.59 92.51 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 123.378 0.424 . . . . 0.0 110.649 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -62.75 -50.83 69.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.268 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.05 78.34 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.139 -179.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -55.8 -55.82 27.87 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.969 0.414 . . . . 0.0 110.895 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 52.6 t90 -64.98 -45.66 84.73 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.442 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -58.61 -49.48 77.32 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.511 -178.515 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 85.6 mt -57.76 -50.17 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.662 0.268 . . . . 0.0 110.877 179.621 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.57 -25.42 64.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.935 -179.719 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -60.81 -38.28 84.86 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.238 0.336 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.51 HD22 ' H ' ' A' ' 19' ' ' LEU . 2.4 mm? -66.58 121.11 75.72 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.016 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -88.75 -8.05 5.25 Favored 'Trans proline' 0 N--CA 1.503 2.031 0 C-N-CA 123.592 2.862 . . . . 0.0 115.587 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -98.97 -2.3 37.73 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.929 0.714 . . . . 0.0 112.929 -177.499 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.497 ' HA ' HE22 ' A' ' 55' ' ' GLN . 30.3 mt -75.98 130.9 39.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.451 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.625 ' H ' HE21 ' A' ' 26' ' ' GLN . 23.2 t-20 -52.28 145.61 10.65 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.199 179.407 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -50.79 -41.0 56.74 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.806 -178.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.59 -42.11 83.03 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.926 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.625 HE21 ' H ' ' A' ' 23' ' ' ASN . 31.8 mt-30 -62.31 -42.18 99.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.697 -179.053 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm -55.42 -63.8 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.632 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -58.21 -32.24 68.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.247 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.77 -62.31 1.89 Allowed 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.174 0.297 . . . . 0.0 111.209 -179.068 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -61.55 -40.29 94.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.086 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.4 -39.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.291 179.025 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -75.1 -39.31 60.79 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.571 178.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.3 m -55.0 -35.45 64.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.544 -179.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.33 -43.98 71.7 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.248 0.342 . . . . 0.0 110.527 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -68.43 -41.01 80.97 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.173 178.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.22 -41.89 94.03 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.098 -178.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.17 85.21 6.98 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 120.862 0.363 . . . . 0.0 111.098 -179.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -54.83 -23.73 35.23 Favored 'Trans proline' 0 N--CA 1.502 1.988 0 C-N-CA 122.908 2.405 . . . . 0.0 112.755 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.7 p -61.91 -27.76 69.04 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.809 -179.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -96.13 8.01 44.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -178.666 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m -44.78 -40.87 6.45 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -178.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -45.39 75.16 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.788 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -67.52 -48.29 67.47 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.705 -179.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -57.33 -45.53 84.17 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.225 0.328 . . . . 0.0 111.291 -178.75 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.2 tp -60.1 -49.34 78.03 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.34 -40.5 94.49 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.817 178.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -64.17 -38.98 92.99 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 179.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.55 -46.55 82.32 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.558 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -63.27 -32.2 73.54 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.046 179.306 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.2 -44.44 95.11 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.897 179.112 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.7 mt -63.21 -39.42 94.57 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.906 178.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.452 ' ND2' HD12 ' A' ' 19' ' ' LEU . 16.4 t-20 -62.98 -49.14 75.89 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.247 178.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -62.42 -38.61 90.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.256 -179.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.52 -51.62 14.19 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.031 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.497 HE22 ' HA ' ' A' ' 22' ' ' LEU . 26.3 mt-30 -66.2 -27.34 67.91 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.132 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.51 145.33 60.13 Favored Pre-proline 0 CA--C 1.539 0.524 0 O-C-N 123.227 0.329 . . . . 0.0 111.266 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -74.74 153.45 43.14 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 122.895 2.396 . . . . 0.0 112.42 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.2 mmtp . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 118.144 -0.931 . . . . 0.0 110.44 179.82 . . . . . . . . 0 0 . 1 stop_ save_