data_2lte_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 2lte _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 ' 27' ' ' MET . . . . . . . . . . . . . 15.6 ttt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.31 -41.39 88.91 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 124.51 1.131 . . . . 0.0 111.539 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.68 -45.29 93.47 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.139 0.576 . . . . 0.0 110.721 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -70.3 -33.48 71.6 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.725 0.641 . . . . 0.0 110.696 -175.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.03 -36.31 61.9 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.899 0.88 . . . . 0.0 108.716 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.62 -32.74 74.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.283 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.516 ' HA ' ' HE3' ' A' ' 43' ' ' LYS . 77.9 m -72.57 -38.25 67.97 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.866 0.866 . . . . 0.0 110.627 176.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.29 -45.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.393 0.677 . . . . 0.0 110.127 172.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 71.6 mt -68.82 -37.15 79.01 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.093 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.5 t -67.98 -29.36 68.37 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.375 0.67 . . . . 0.0 111.448 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.4 t -85.23 -43.11 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 123.439 0.696 . . . . 0.0 110.272 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.9 -43.72 87.34 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.534 0.734 . . . . 0.0 111.222 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 m -81.41 -30.44 33.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.849 0.859 . . . . 0.0 110.169 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.07 -11.29 65.48 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.397 -0.365 . . . . 0.0 113.331 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 33.4 m -91.15 145.16 31.05 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 123.842 0.857 . . . . 0.0 110.61 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -54.88 169.91 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.852 3.034 . . . . 0.0 115.432 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 33' ' ' THR . 44.5 mmtm -60.25 -34.92 74.37 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.115 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.85 -30.95 71.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.314 0.646 . . . . 0.0 111.571 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.55 -4.29 55.6 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mt -127.34 133.29 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.278 0.631 . . . . 0.0 109.507 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.6 t -135.51 167.83 20.36 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.586 0.754 . . . . 0.0 109.44 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -64.38 -55.68 19.45 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.75 89.82 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -170.31 154.26 4.76 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.197 -1.365 . . . . 0.0 108.457 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -94.25 153.34 18.09 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 123.79 0.836 . . . . 0.0 109.472 177.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.658 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 20.0 mmt -73.59 97.17 2.57 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.87 -121.61 0.26 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.374 1.069 . . . . 0.0 108.514 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -85.25 54.46 3.11 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 122.717 1.246 . . . . 0.0 109.25 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.2 mt -127.79 -46.41 1.42 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.778 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.509 ' HB1' ' SD ' ' A' ' 52' ' ' MET . . . -163.71 21.7 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.426 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.658 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 49.0 t80 -122.58 75.85 1.29 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 121.965 0.888 . . . . 0.0 110.023 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.5 t70 179.55 135.74 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 113.506 -1.679 . . . . 0.0 107.16 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.3 p -52.03 -39.21 59.18 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.893 0.877 . . . . 0.0 113.118 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -68.09 -47.86 67.09 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.764 0.426 . . . . 0.0 110.677 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.47 -28.18 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 -176.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.9 t -74.75 -38.27 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.753 0.821 . . . . 0.0 109.86 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -68.07 -35.28 77.95 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.918 0.487 . . . . 0.0 110.525 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 10.5 tp10 -70.84 -42.92 69.53 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.388 0.675 . . . . 0.0 109.922 176.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.479 HD23 ' HB3' ' A' ' 56' ' ' ALA . 56.0 tp -61.29 -48.43 81.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.305 1.042 . . . . 0.0 110.502 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 32.6 t -57.96 -47.64 82.33 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.134 0.974 . . . . 0.0 109.593 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 45.0 tp -53.29 -40.61 64.84 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.15 0.98 . . . . 0.0 111.22 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 71.9 mmtt -65.81 -55.11 18.85 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.566 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 97.7 mt -56.68 -32.14 65.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.082 0.953 . . . . 0.0 112.588 -173.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 66' ' ' SER . 45.7 mtm180 -59.75 -37.06 77.94 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.493 0.717 . . . . 0.0 111.044 178.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -93.91 -49.22 5.91 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.863 0.865 . . . . 0.0 111.239 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.59 -40.66 69.75 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.768 0.827 . . . . 0.0 111.83 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -125.5 -6.11 7.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.128 0.571 . . . . 0.0 111.909 -175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 75.78 3.6 73.96 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 113.609 0.204 . . . . 0.0 113.609 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.647 HG23 HG12 ' A' ' 95' ' ' VAL . 75.1 t -77.91 98.81 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.991 0.916 . . . . 0.0 109.679 -176.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 25.3 m -123.45 149.69 44.77 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.976 0.911 . . . . 0.0 110.168 -172.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.58 15.25 80.62 Favored Glycine 0 C--N 1.354 1.552 0 O-C-N 123.436 0.46 . . . . 0.0 113.827 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 15.9 m -92.05 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.166 0.986 . . . . 0.0 112.225 -173.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -54.42 -45.62 73.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.123 0.969 . . . . 0.0 111.938 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -65.5 -38.42 89.66 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 124.161 0.913 . . . . 0.0 110.982 -178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.464 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 5.1 mp0 -65.85 -40.38 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.248 1.019 . . . . 0.0 110.947 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.436 ' HA ' ' HG ' ' A' ' 85' ' ' LEU . 85.6 mt -76.01 -25.24 55.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 110.784 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.06 -28.34 62.26 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.061 0.944 . . . . 0.0 110.424 173.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -90.95 10.18 27.56 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.319 1.048 . . . . 0.0 112.35 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.496 HD11 ' HE2' ' A' ' 52' ' ' MET . 78.9 mt -79.53 126.99 31.58 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.89 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -126.73 -45.95 1.59 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.412 1.085 . . . . 0.0 108.083 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 35.5 p -115.61 154.86 28.68 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.816 0.817 . . . . 0.0 110.767 172.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.485 ' HA ' ' HE3' ' A' ' 52' ' ' MET . 53.0 t -70.74 -36.82 66.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.115 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.71 -37.77 82.79 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.229 0.611 . . . . 0.0 110.56 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.27 -39.06 85.5 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 124.05 0.844 . . . . 0.0 110.854 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.409 HD13 HD13 ' A' ' 85' ' ' LEU . 44.3 tp -62.71 -42.36 99.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 123.401 0.438 . . . . 0.0 111.397 174.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -59.57 -45.3 92.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.987 0.515 . . . . 0.0 110.638 175.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.15 -31.82 70.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.016 0.927 . . . . 0.0 111.445 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tt -70.22 -55.82 8.34 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.789 0.836 . . . . 0.0 109.653 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.647 HG12 HG23 ' A' ' 75' ' ' VAL . 59.6 t -64.49 -29.19 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 O-C-N 124.076 0.86 . . . . 0.0 110.15 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -61.53 -54.17 46.72 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.077 0.951 . . . . 0.0 110.175 173.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -69.41 -27.19 65.07 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.741 0.816 . . . . 0.0 111.308 -178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -79.23 -32.29 43.88 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.927 0.891 . . . . 0.0 110.22 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -74.23 -41.09 61.91 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.475 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.47 97.29 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.706 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.106 0 C-N-CA 125.367 1.467 . . . . 0.0 112.295 178.355 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 119.411 -0.328 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.475 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 45.3 tt0 -73.16 -64.26 1.01 Allowed 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -171.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.07 -34.02 74.24 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.81 0.844 . . . . 0.0 110.115 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -63.55 -42.8 98.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.094 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.497 HD21 ' HG ' ' A' ' 91' ' ' LEU . 33.6 tp -74.36 -33.07 62.99 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.519 0.512 . . . . 0.0 110.959 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.6 -28.78 69.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.329 0.252 . . . . 0.0 110.874 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.425 ' HA ' ' HG ' ' A' ' 36' ' ' SER . 32.3 m -72.41 -43.77 63.4 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.827 0.451 . . . . 0.0 110.297 172.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.87 -44.49 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.705 0.802 . . . . 0.0 110.567 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.12 -42.51 80.08 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.348 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.425 ' HG ' ' HA ' ' A' ' 33' ' ' THR . 77.9 p -65.79 -34.74 78.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.729 0.299 . . . . 0.0 111.53 -176.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.28 -36.79 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 C-N-CA 123.497 0.719 . . . . 0.0 110.83 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.32 -36.93 45.75 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.873 0.469 . . . . 0.0 112.038 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 m -87.23 -55.16 3.94 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.925 0.89 . . . . 0.0 110.33 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.5 -24.74 7.96 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.738 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.6 m -76.29 131.26 75.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 122.912 0.485 . . . . 0.0 110.041 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.48 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 25.5 Cg_endo -61.27 161.74 22.34 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.683 2.256 . . . . 0.0 112.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -59.39 -26.06 64.81 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 124.874 1.27 . . . . 0.0 112.467 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -68.38 -24.46 64.78 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.942 0.897 . . . . 0.0 111.369 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.48 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 12.9 mm-40 -85.92 -19.1 31.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.684 0.793 . . . . 0.0 110.92 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.3 mt -99.62 133.75 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.601 0.761 . . . . 0.0 110.33 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 t -121.86 168.55 11.73 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.861 0.864 . . . . 0.0 109.136 172.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -73.34 -20.55 60.76 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.926 0.491 . . . . 0.0 111.832 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.97 1.07 30.74 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.801 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.5 t -65.32 152.14 44.52 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.203 0.601 . . . . 0.0 111.942 -171.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -73.87 160.47 31.38 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.616 0.767 . . . . 0.0 110.606 175.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.666 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 17.4 mmt -104.9 26.67 8.92 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.063 0.945 . . . . 0.0 110.805 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.05 -61.65 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.165 0.507 . . . . 0.0 110.468 -170.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -94.07 -16.16 24.08 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.1 mp -85.61 -17.08 37.22 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.184 0.994 . . . . 0.0 112.278 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.666 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -156.42 -152.82 0.39 Allowed 'General case' 0 C--O 1.246 0.908 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 62.56 61.79 1.19 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.445 1.098 . . . . 0.0 112.125 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -177.03 137.52 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 113.197 -1.819 . . . . 0.0 106.918 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.7 m -56.47 -35.44 67.94 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.745 0.653 . . . . 0.0 111.752 -175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -81.48 -38.48 26.28 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.958 0.503 . . . . 0.0 110.822 -174.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.36 -39.71 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 121.372 0.606 . . . . 0.0 110.752 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.5 HG11 ' HB2' ' A' ' 82' ' ' LEU . 56.1 t -72.8 -31.3 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.567 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.5 t -69.03 -33.77 74.16 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.688 0.395 . . . . 0.0 110.309 173.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -70.49 -40.4 73.63 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.158 0.983 . . . . 0.0 110.035 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 38.6 tp -74.36 -35.21 63.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.946 0.899 . . . . 0.0 111.246 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.3 p -72.49 -40.78 66.63 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.845 0.458 . . . . 0.0 109.938 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.0 tp -58.3 -38.76 77.7 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 124.181 0.925 . . . . 0.0 110.466 171.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -64.03 -57.97 8.08 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.469 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.409 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 91.2 mt -62.16 -36.27 81.33 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.579 0.752 . . . . 0.0 111.471 -177.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -56.18 -42.73 77.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.827 1.251 . . . . 0.0 110.886 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -86.66 -32.65 20.42 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.261 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -90.42 -55.04 3.74 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.962 0.505 . . . . 0.0 111.786 -165.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -110.73 -1.83 16.5 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.847 0.859 . . . . 0.0 110.813 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.12 7.13 86.71 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.126 0.393 . . . . 0.0 113.245 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.409 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 42.4 t -81.92 95.02 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 123.597 0.759 . . . . 0.0 109.68 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.5 m -111.12 155.25 23.13 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.295 1.038 . . . . 0.0 111.322 -171.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.53 80.45 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 116.583 -0.28 . . . . 0.0 113.491 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 30.3 m -93.07 16.1 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.913 0.885 . . . . 0.0 111.551 -176.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -54.87 -52.48 62.69 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.139 0.975 . . . . 0.0 111.042 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -57.29 -42.91 82.6 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 24.1 mm-40 -60.55 -37.21 80.5 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.23 0.612 . . . . 0.0 111.421 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.5 ' HB2' HG11 ' A' ' 62' ' ' VAL . 87.3 mt -66.18 -35.29 80.06 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.956 0.902 . . . . 0.0 111.226 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -58.86 -43.0 90.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.698 172.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.7 -21.04 61.83 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 82.8 mt -76.76 126.78 31.56 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.53 0.332 . . . . 0.0 110.667 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -102.96 -26.75 12.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.525 0.73 . . . . 0.0 111.107 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 37.0 p -131.4 164.19 26.24 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.408 0.623 . . . . 0.0 111.263 -178.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.5 ' HA ' ' HE1' ' A' ' 52' ' ' MET . 85.7 t -69.3 -36.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.016 -176.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.13 -29.27 68.14 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.977 0.511 . . . . 0.0 111.54 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.412 ' HB3' HD22 ' A' ' 85' ' ' LEU . 47.1 mt-10 -66.5 -39.44 88.71 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.608 0.363 . . . . 0.0 110.476 171.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.497 ' HG ' HD21 ' A' ' 31' ' ' LEU . 37.5 tp -62.76 -42.78 99.84 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.983 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.1 m-85 -57.95 -58.24 9.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.436 0.694 . . . . 0.0 111.328 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -64.07 -24.88 67.87 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.443 0.464 . . . . 0.0 111.533 -176.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.6 tp -69.94 -50.04 45.92 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.293 0.371 . . . . 0.0 110.305 175.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 89.6 t -58.58 -44.99 90.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.056 0.542 . . . . 0.0 110.326 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -67.44 -46.74 72.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.83 0.852 . . . . 0.0 111.895 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -63.23 -56.13 19.11 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.495 0.718 . . . . 0.0 110.589 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -65.95 -22.27 66.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.367 1.067 . . . . 0.0 112.0 -175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -68.94 -56.95 6.26 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.266 0.626 . . . . 0.0 110.261 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -88.35 -62.41 1.5 Allowed 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.348 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.618 0 C-N-CA 123.6 0.76 . . . . 0.0 110.027 179.589 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.6 tmm? . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.38 -41.44 89.38 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.612 0.765 . . . . 0.0 111.349 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -74.22 -29.91 61.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.947 1.299 . . . . 0.0 110.814 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.409 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.1 t60 -70.79 -48.72 52.72 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.702 0.801 . . . . 0.0 109.792 -178.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.508 HD23 ' HG ' ' A' ' 91' ' ' LEU . 8.1 mp -62.62 -35.98 81.29 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.265 0.978 . . . . 0.0 110.384 175.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -61.19 -39.5 90.4 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.915 0.886 . . . . 0.0 110.905 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.4 m -70.23 -39.76 74.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.896 0.878 . . . . 0.0 110.977 175.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.485 HG11 ' HG2' ' A' ' 68' ' ' LYS . 64.5 t -59.77 -48.41 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.367 0.667 . . . . 0.0 110.553 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.32 -31.5 71.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.722 0.809 . . . . 0.0 111.256 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 t -61.72 -43.21 99.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.306 0.642 . . . . 0.0 111.356 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.6 t -79.07 -46.03 23.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.036 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.5 -43.27 73.46 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.852 0.861 . . . . 0.0 112.085 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 m -91.8 -15.35 28.38 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.156 0.582 . . . . 0.0 111.617 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.12 21.5 70.51 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 114.239 0.455 . . . . 0.0 114.239 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.47 152.76 42.91 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 124.245 1.018 . . . . 0.0 110.442 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.76 151.92 45.19 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.506 2.137 . . . . 0.0 112.384 165.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.75 -26.41 68.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.756 0.822 . . . . 0.0 111.32 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -75.28 -19.98 59.39 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.138 0.975 . . . . 0.0 111.573 -176.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.59 -36.59 73.64 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.551 0.691 . . . . 0.0 109.487 176.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.437 HG22 HG23 ' A' ' 88' ' ' VAL . 47.9 mt -91.18 89.65 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.827 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -94.18 26.49 3.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.715 0.806 . . . . 0.0 110.669 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.16 -48.17 0.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.136 1.774 . . . . 0.0 110.302 -168.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.28 82.35 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.595 0.758 . . . . 0.0 109.683 164.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.458 ' HB2' HG23 ' A' ' 88' ' ' VAL . 48.8 m -160.57 153.76 21.74 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.548 1.139 . . . . 0.0 109.127 -177.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -101.58 135.95 42.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.058 0.943 . . . . 0.0 109.953 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.518 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 71.9 mmm -81.54 6.41 14.96 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.963 0.505 . . . . 0.0 111.644 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.81 -30.95 71.17 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.491 0.716 . . . . 0.0 111.265 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.44 -43.67 6.81 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.401 167.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 62.2 mt -75.97 -11.5 59.97 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.488 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -169.36 13.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -108.3 -20.14 13.24 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 118.477 0.581 . . . . 0.0 112.341 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.413 ' O ' HG21 ' A' ' 62' ' ' VAL . 24.3 t70 -70.68 135.47 48.35 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 m -54.38 -35.84 63.26 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -172.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.45 -41.12 73.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.27 -35.89 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 123.866 0.729 . . . . 0.0 111.286 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.413 HG21 ' O ' ' A' ' 58' ' ' ASP . 62.4 t -64.06 -44.9 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.7 t -69.24 -37.82 78.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.922 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.93 -35.34 64.59 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.788 0.835 . . . . 0.0 110.796 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.15 -41.39 63.98 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.183 0.993 . . . . 0.0 109.527 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.3 t -60.23 -43.57 95.94 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.709 0.803 . . . . 0.0 109.835 173.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.72 -40.47 95.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.801 1.24 . . . . 0.0 110.639 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HG2' HG11 ' A' ' 34' ' ' VAL . 6.7 tppt? -72.39 -56.58 5.22 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.246 -171.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.551 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 87.2 mt -57.99 -34.47 70.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.542 0.737 . . . . 0.0 111.261 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.47 ' HG3' ' HB ' ' A' ' 76' ' ' THR . 72.0 ttt180 -59.04 -34.9 72.46 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.07 1.348 . . . . 0.0 112.222 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -94.32 -58.39 2.23 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 122.953 0.501 . . . . 0.0 110.342 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -54.02 -44.43 70.94 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.663 1.185 . . . . 0.0 112.31 -176.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -118.75 -27.22 5.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.25 0.62 . . . . 0.0 112.162 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.8 7.08 64.91 Favored Glycine 0 N--CA 1.471 1.023 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.551 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 99.0 t -75.85 90.36 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.045 0 C-N-CA 124.153 0.981 . . . . 0.0 109.44 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.47 ' HB ' ' HG3' ' A' ' 70' ' ' ARG . 11.4 t -115.2 163.87 15.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.134 0.974 . . . . 0.0 111.069 -174.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 21.71 65.28 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.701 -0.682 . . . . 0.0 113.359 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.409 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 20.6 m -97.97 13.64 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.955 0.902 . . . . 0.0 111.646 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -48.85 -51.01 31.94 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.415 1.486 . . . . 0.0 112.373 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.51 -50.53 72.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.963 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.67 -30.34 71.31 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.29 -177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.6 mt -70.47 -36.18 73.73 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.257 0.623 . . . . 0.0 110.244 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -74.59 -23.96 58.82 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.135 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.79 -13.21 59.93 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.985 0.514 . . . . 0.0 111.752 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 80.3 mt -70.74 158.76 35.72 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.715 0.406 . . . . 0.0 110.734 176.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -136.57 -42.53 0.61 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.05 0.54 . . . . 0.0 110.103 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.418 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 74.9 p -115.71 159.44 21.39 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.315 0.646 . . . . 0.0 111.084 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.458 HG23 ' HB2' ' A' ' 50' ' ' SER . 69.0 t -59.21 -36.69 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.137 177.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -58.52 -35.71 72.7 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.458 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.418 ' HG2' ' OG1' ' A' ' 87' ' ' THR . 37.0 mm-40 -70.52 -37.3 74.09 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.251 0.621 . . . . 0.0 111.743 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.508 ' HG ' HD23 ' A' ' 31' ' ' LEU . 65.7 tp -61.88 -42.53 99.18 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 121.149 0.5 . . . . 0.0 110.607 173.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -63.06 -38.19 90.19 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.436 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 86.8 mm-40 -64.98 -48.27 74.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.913 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.4 tt -53.15 -61.06 2.54 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.532 1.133 . . . . 0.0 110.161 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.464 HG13 HD11 ' A' ' 31' ' ' LEU . 43.7 t -68.63 -31.62 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.236 -173.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.639 ' HG3' HH21 ' A' ' 99' ' ' ARG . 40.3 tt0 -61.05 -45.17 95.87 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.24 0.616 . . . . 0.0 111.086 174.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 74.1 mmtt -67.98 -46.26 71.85 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.869 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -70.06 -24.63 63.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.879 0.471 . . . . 0.0 111.551 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.639 HH21 ' HG3' ' A' ' 96' ' ' GLU . 18.5 ttp180 -66.84 -44.49 80.94 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.856 0.862 . . . . 0.0 109.853 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -89.54 -0.41 57.49 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.61 0.764 . . . . 0.0 111.94 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.032 0 C-N-CA 125.297 1.439 . . . . 0.0 111.412 -179.471 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 120.789 0.328 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.415 ' HA ' HD21 ' A' ' 31' ' ' LEU . 39.1 mt-10 -65.52 -32.67 74.39 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.141 0.976 . . . . 0.0 111.143 -175.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.03 -47.44 71.57 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 124.398 1.061 . . . . 0.0 110.793 172.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.427 ' O ' HG21 ' A' ' 34' ' ' VAL . 7.7 m-70 -72.77 -26.65 61.62 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.437 -175.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD12 HG22 ' A' ' 95' ' ' VAL . 3.5 mm? -60.79 -45.52 94.09 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.731 0.696 . . . . 0.0 109.314 168.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 5.9 mp -66.11 -36.31 82.83 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.478 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -68.25 -42.31 79.84 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.576 0.75 . . . . 0.0 110.682 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.537 HG13 ' HD2' ' A' ' 68' ' ' LYS . 61.3 t -61.13 -49.83 83.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.857 0.463 . . . . 0.0 110.505 178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 90.8 mt -66.74 -39.17 87.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.928 0.767 . . . . 0.0 112.291 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.9 p -65.52 -45.2 84.44 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.154 0.582 . . . . 0.0 111.59 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.0 t -71.13 -30.49 41.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 114.68 -1.145 . . . . 0.0 110.3 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.457 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.62 -37.24 62.87 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.061 0.544 . . . . 0.0 112.203 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.467 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 80.7 p -95.01 -60.95 1.57 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.183 0.593 . . . . 0.0 110.993 -173.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.5 -30.95 2.27 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.003 -177.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -72.12 141.3 83.68 Favored Pre-proline 0 C--N 1.356 0.854 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.899 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.538 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 19.3 Cg_endo -59.47 152.59 60.42 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.457 2.105 . . . . 0.0 112.307 176.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.462 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 13.7 ptmm? -60.78 -20.3 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.426 1.09 . . . . 0.0 112.316 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.63 -35.64 80.67 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.839 0.855 . . . . 0.0 111.32 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.538 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 20.3 mm-40 -75.94 -11.97 60.06 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.684 0.794 . . . . 0.0 111.942 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.432 ' HB ' ' HG ' ' A' ' 32' ' ' LEU . 23.7 mt -98.17 123.12 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 123.056 0.542 . . . . 0.0 110.478 -176.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.7 p -136.1 179.33 6.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.416 1.486 . . . . 0.0 107.692 172.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.495 ' HB2' ' HB2' ' A' ' 89' ' ' ASP . 8.4 ptm180 -52.17 -56.36 15.06 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 123.558 0.743 . . . . 0.0 112.566 177.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -94.61 17.66 12.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.631 -0.668 . . . . 0.0 111.919 -175.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.0 t -70.55 -13.31 62.05 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.079 0.552 . . . . 0.0 111.165 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.441 ' HD3' HG22 ' A' ' 87' ' ' THR . 26.7 mmt180 71.51 177.06 0.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.145 1.378 . . . . 0.0 111.44 175.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.5 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 34.4 mtt -129.44 29.0 5.14 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.654 0.782 . . . . 0.0 111.401 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -56.78 -40.57 76.11 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.595 0.758 . . . . 0.0 110.659 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.03 -23.92 7.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.238 1.015 . . . . 0.0 110.597 174.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.5 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 5.0 mp -77.2 -30.17 54.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.682 0.793 . . . . 0.0 112.82 -166.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.473 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -166.03 89.18 0.4 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.4 0.68 . . . . 0.0 110.499 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -160.22 -33.65 0.06 Allowed 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.942 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -63.92 147.42 52.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.958 0.903 . . . . 0.0 111.424 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -55.76 -44.88 78.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.852 0.861 . . . . 0.0 112.422 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.3 tp -68.68 -39.28 80.63 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.732 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.457 HG13 ' HB1' ' A' ' 38' ' ' ALA . 81.0 t -65.8 -48.91 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 78.4 t -68.32 -38.82 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.753 0.821 . . . . 0.0 111.439 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.491 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 68.4 p -61.96 -55.66 27.13 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -61.65 -27.46 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.626 0.77 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 41.6 tp -64.26 -49.05 73.4 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.149 0.979 . . . . 0.0 109.852 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 85.2 p -68.24 -34.75 76.79 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.568 0.347 . . . . 0.0 111.26 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 63' ' ' SER . 85.1 mt -68.67 -33.09 73.39 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.703 0.801 . . . . 0.0 111.788 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.537 ' HD2' HG13 ' A' ' 34' ' ' VAL . 29.4 ttmt -85.5 -43.72 13.32 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.804 -175.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 94.3 mt -61.25 -27.9 68.78 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.534 0.734 . . . . 0.0 110.766 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -57.69 -40.2 78.91 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.575 1.15 . . . . 0.0 111.065 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -85.48 -45.77 11.5 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.19 0.596 . . . . 0.0 111.105 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.78 -51.96 35.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.129 0.972 . . . . 0.0 111.878 -170.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -123.51 -4.46 8.26 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.311 0.644 . . . . 0.0 112.176 -173.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.72 12.8 84.12 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-O 120.182 -0.232 . . . . 0.0 113.288 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.455 HG13 HG22 ' A' ' 78' ' ' VAL . 57.3 t -86.79 107.13 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.861 0.865 . . . . 0.0 109.406 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 m -136.89 156.33 48.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.447 1.099 . . . . 0.0 109.597 -171.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.04 35.25 90.36 Favored Glycine 0 C--N 1.354 1.549 0 O-C-N 123.672 0.607 . . . . 0.0 111.996 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.455 HG22 HG13 ' A' ' 75' ' ' VAL . 20.5 m -119.62 4.21 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.387 1.075 . . . . 0.0 110.704 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.476 ' HA ' HD11 ' A' ' 82' ' ' LEU . 7.1 p-10 -55.83 -37.94 69.38 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.496 1.119 . . . . 0.0 112.656 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.55 -50.93 71.99 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.789 0.681 . . . . 0.0 110.744 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.76 -23.52 64.33 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.921 -178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.476 HD11 ' HA ' ' A' ' 79' ' ' ASP . 87.7 mt -73.27 -31.26 63.96 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.551 0.741 . . . . 0.0 111.19 175.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.21 -37.37 85.39 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.522 0.514 . . . . 0.0 109.774 171.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.99 -0.26 30.39 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.014 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.502 HD12 HD13 ' A' ' 94' ' ' LEU . 79.6 mt -82.17 144.24 30.87 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 169.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.36 -8.44 2.56 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.992 0.917 . . . . 0.0 110.38 174.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.441 HG22 ' HD3' ' A' ' 51' ' ' ARG . 4.2 m -138.96 147.1 41.79 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.49 ' HA ' ' HE2' ' A' ' 52' ' ' MET . 67.1 t -71.97 -31.91 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.676 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.495 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 38.2 t70 -56.79 -40.62 76.23 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.816 0.846 . . . . 0.0 110.059 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.71 -29.57 64.7 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.979 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.476 ' HB2' ' HE1' ' A' ' 52' ' ' MET . 67.1 tp -64.19 -45.52 87.98 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.218 0.607 . . . . 0.0 111.162 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -58.64 -45.55 89.06 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.682 0.614 . . . . 0.0 109.653 177.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 19.0 mm100 -61.78 -38.59 88.64 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.293 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.502 HD13 HD12 ' A' ' 85' ' ' LEU . 9.6 tt -62.68 -61.79 2.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.042 0.937 . . . . 0.0 110.207 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.454 HG11 HG23 ' A' ' 75' ' ' VAL . 92.5 t -60.6 -44.53 97.02 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.129 -172.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -66.45 -35.62 80.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -67.36 -38.06 84.19 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.693 0.224 . . . . 0.0 111.475 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -84.34 -17.67 38.71 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.008 0.523 . . . . 0.0 111.981 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -82.3 -48.46 11.17 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.52 37.29 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.61 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.178 0 C-N-CA 124.685 1.194 . . . . 0.0 111.09 -177.603 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.6 ptm . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.2 -56.13 16.87 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.36 -35.53 80.59 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.034 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -70.5 -51.66 27.39 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.955 0.902 . . . . 0.0 110.742 -169.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HA ' HG11 ' A' ' 34' ' ' VAL . 4.1 mm? -66.95 -33.76 76.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.331 0.395 . . . . 0.0 110.154 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.5 -32.79 74.58 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 110.588 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.401 ' O ' HG22 ' A' ' 37' ' ' VAL . 97.8 m -71.93 -51.32 22.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.427 0.691 . . . . 0.0 111.018 178.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.455 HG11 ' HA ' ' A' ' 31' ' ' LEU . 13.3 p -62.46 -31.65 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 122.208 0.203 . . . . 0.0 110.819 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.53 HD11 HD21 ' A' ' 91' ' ' LEU . 87.1 mt -73.16 -34.2 65.9 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.252 0.621 . . . . 0.0 111.439 173.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.6 t -64.64 -36.6 84.77 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.371 0.668 . . . . 0.0 111.12 177.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 33' ' ' THR . 22.0 t -82.77 -25.29 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.517 0.727 . . . . 0.0 110.224 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.498 ' HB1' HG11 ' A' ' 61' ' ' VAL . . . -74.56 -43.71 54.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.45 0.7 . . . . 0.0 111.453 178.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.8 p -86.94 -50.39 6.71 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.758 0.823 . . . . 0.0 110.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 122.78 -33.04 4.23 Favored Glycine 0 C--N 1.341 0.817 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.007 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.1 m -73.43 130.17 84.54 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 123.006 0.522 . . . . 0.0 111.124 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -54.77 157.53 12.52 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.397 2.731 . . . . 0.0 114.151 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -56.85 -27.4 60.24 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.358 1.063 . . . . 0.0 112.463 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -68.17 -21.37 64.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.757 0.823 . . . . 0.0 111.801 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -105.33 2.98 29.36 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.541 0.737 . . . . 0.0 111.545 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -113.04 120.91 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.293 0.637 . . . . 0.0 109.307 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.6 m -100.85 167.31 10.36 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.318 0.647 . . . . 0.0 109.302 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -71.29 -19.41 62.34 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.836 0.35 . . . . 0.0 110.757 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -123.23 79.23 1.65 Allowed 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.4 m -125.08 20.27 8.26 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.549 1.14 . . . . 0.0 108.929 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 56.08 -169.84 0.09 Allowed 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 112.312 -170.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.447 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 49.8 ttm -147.24 84.8 1.58 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.577 0.703 . . . . 0.0 109.254 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.36 -4.13 8.37 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.608 174.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -137.18 -36.41 0.66 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.333 0.653 . . . . 0.0 110.63 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 69.6 mt -66.64 -36.85 83.56 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -167.65 79.81 0.18 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.526 0.73 . . . . 0.0 110.142 177.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -147.76 -15.79 0.37 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.468 0.307 . . . . 0.0 111.327 -175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -91.7 150.22 21.24 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.719 0.808 . . . . 0.0 109.338 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -54.04 -45.86 71.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.92 0.888 . . . . 0.0 112.616 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.05 -36.1 74.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.716 0.407 . . . . 0.0 110.551 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.498 HG11 ' HB1' ' A' ' 38' ' ' ALA . 38.4 t -71.3 -40.35 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.214 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 51.3 t -69.81 -39.8 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.915 0.886 . . . . 0.0 110.291 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.474 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 41.5 t -64.37 -46.31 83.92 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.634 0.584 . . . . 0.0 110.264 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -62.19 -43.43 98.86 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.975 0.797 . . . . 0.0 110.563 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.57 -49.34 72.98 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.929 173.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.9 t -65.64 -22.79 66.69 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.159 0.984 . . . . 0.0 112.081 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 63' ' ' SER . 91.1 mt -67.61 -52.12 42.21 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -26.12 61.26 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.36 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.585 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 30.8 mt -67.79 -46.26 72.5 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 174.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -63.28 -42.24 99.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.023 0.929 . . . . 0.0 110.515 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -69.64 -46.4 66.25 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.51 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.33 -49.53 4.22 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.82 -168.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -97.75 -11.64 23.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.377 0.671 . . . . 0.0 111.982 -174.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.02 8.66 86.92 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 123.328 0.392 . . . . 0.0 113.968 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 46.2 t -86.46 108.21 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.35 0.66 . . . . 0.0 110.529 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.0 t -150.31 167.24 27.6 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.99 0.916 . . . . 0.0 109.756 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 24.32 75.14 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 112.046 -0.422 . . . . 0.0 112.046 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 75' ' ' VAL . 31.6 m -126.09 18.19 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.431 1.092 . . . . 0.0 110.965 -172.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -51.85 -40.92 61.36 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.586 1.154 . . . . 0.0 113.2 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -70.1 -39.41 75.53 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.009 0.924 . . . . 0.0 110.681 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.26 -33.08 71.18 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.394 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.94 -29.84 62.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.715 0.806 . . . . 0.0 111.094 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -73.05 -32.54 65.12 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.969 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.41 -17.86 61.77 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.637 0.775 . . . . 0.0 110.632 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.04 132.96 55.05 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.218 0.607 . . . . 0.0 111.849 177.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.26 -6.55 5.37 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.985 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.6 p -139.94 154.35 47.19 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.412 0.625 . . . . 0.0 111.398 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.4 t -68.58 -40.81 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.771 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.477 ' HA ' ' HD2' ' A' ' 92' ' ' PHE . 9.4 t70 -64.94 -30.21 71.19 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.755 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.26 -41.38 81.16 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.259 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.53 HD21 HD11 ' A' ' 35' ' ' LEU . 59.6 tp -62.63 -42.08 99.39 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 123.464 0.477 . . . . 0.0 111.036 175.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.477 ' HD2' ' HA ' ' A' ' 89' ' ' ASP . 27.0 m-85 -54.57 -48.77 71.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.868 0.467 . . . . 0.0 110.525 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.472 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 79.7 mt-30 -68.96 -37.79 79.03 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.555 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.8 tt -57.46 -55.88 29.04 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.904 0.882 . . . . 0.0 110.2 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.4 HG22 HD13 ' A' ' 31' ' ' LEU . 84.9 t -61.26 -42.55 93.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.491 -178.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -56.67 -42.44 79.01 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.266 0.979 . . . . 0.0 110.771 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 33.4 mmtp -66.64 -47.29 73.04 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.687 0.395 . . . . 0.0 111.737 -178.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -74.96 -18.43 60.39 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.976 0.51 . . . . 0.0 112.043 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -82.64 -55.41 4.47 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.539 0.736 . . . . 0.0 109.955 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.31 -26.69 62.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.751 0.82 . . . . 0.0 111.594 -176.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.651 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 170.792 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 23.1 ptm . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.461 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 42.9 mt-10 -59.05 -57.15 14.35 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.491 0.716 . . . . 0.0 112.767 -167.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.68 -25.29 67.88 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.984 0.803 . . . . 0.0 111.816 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.462 ' O ' HG22 ' A' ' 34' ' ' VAL . 40.1 m80 -67.93 -45.41 74.4 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.64 0.587 . . . . 0.0 110.287 171.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.496 HD22 HG21 ' A' ' 95' ' ' VAL . 7.4 mp -67.26 -28.93 68.44 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.544 0.337 . . . . 0.0 111.495 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.523 ' HA ' HG22 ' A' ' 46' ' ' ILE . 8.4 mp -63.24 -38.7 92.18 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.696 0.399 . . . . 0.0 109.991 172.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -73.99 -34.11 64.07 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.086 0.866 . . . . 0.0 110.656 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 30' ' ' HIS . 55.4 t -63.06 -58.06 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.141 0.576 . . . . 0.0 110.2 178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.42 -40.77 97.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.548 0.739 . . . . 0.0 111.455 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.9 p -63.2 -56.9 12.8 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.467 0.479 . . . . 0.0 111.32 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.1 t -67.44 -41.38 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 C-N-CA 123.336 0.654 . . . . 0.0 111.271 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.69 -28.2 68.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.208 0.603 . . . . 0.0 112.145 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.9 m -92.9 -25.63 17.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.968 0.507 . . . . 0.0 111.394 177.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.88 17.15 58.53 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 123.001 0.334 . . . . 0.0 112.915 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.4 m -102.11 160.76 25.46 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 124.617 1.167 . . . . 0.0 109.945 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -70.23 158.67 55.62 Favored 'Trans proline' 0 C--N 1.368 1.595 0 C-N-CA 122.323 2.015 . . . . 0.0 112.692 168.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -64.76 -20.01 66.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.81 0.844 . . . . 0.0 111.182 173.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.94 -31.52 65.05 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.286 1.034 . . . . 0.0 110.97 173.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -96.4 15.84 20.2 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.99 0.916 . . . . 0.0 111.104 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.523 HG22 ' HA ' ' A' ' 32' ' ' LEU . 21.1 mm -123.46 141.11 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.69 0.796 . . . . 0.0 109.621 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 p -155.43 -168.6 2.88 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.173 0.989 . . . . 0.0 109.706 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.457 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 62.0 mtp85 -75.18 -9.09 58.23 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 176.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -162.71 92.93 0.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 161.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.7 t -106.27 14.13 27.89 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.191 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.673 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 44.8 mmt-85 60.84 104.5 0.02 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 124.37 1.068 . . . . 0.0 111.757 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.459 ' SD ' HD22 ' A' ' 91' ' ' LEU . 71.4 mtm -74.38 -2.16 24.13 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.936 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.673 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 12.7 pt-20 -61.06 -31.41 71.06 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.144 0.578 . . . . 0.0 110.908 173.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -87.51 -39.53 15.09 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.766 0.826 . . . . 0.0 109.986 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 25.9 mt -81.87 -86.49 0.1 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.724 -171.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -104.44 80.37 1.68 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.497 0.719 . . . . 0.0 110.199 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -145.0 -11.05 0.57 Allowed 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.809 -177.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.45 148.02 26.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -53.8 -40.23 66.16 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.164 0.985 . . . . 0.0 112.638 -174.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -74.39 -39.03 62.94 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.09 0.556 . . . . 0.0 110.708 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 22.7 t -70.9 -37.23 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 116.795 -0.184 . . . . 0.0 110.983 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.4 t -68.62 -34.03 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 123.583 0.753 . . . . 0.0 110.011 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.1 t -67.22 -42.15 84.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.876 0.47 . . . . 0.0 110.73 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.86 -23.09 52.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.084 0.954 . . . . 0.0 111.643 177.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.13 -50.28 42.16 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 173.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.5 t -60.96 -41.96 97.35 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.48 1.112 . . . . 0.0 110.772 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.0 tp -57.93 -48.87 78.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.539 1.136 . . . . 0.0 110.715 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -68.33 -40.85 81.48 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.141 0.976 . . . . 0.0 111.073 -175.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.415 ' HA ' ' HD1' ' A' ' 73' ' ' PHE . 90.1 mt -65.13 -41.57 94.71 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.499 0.72 . . . . 0.0 110.591 179.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -70.59 -34.69 72.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.67 0.788 . . . . 0.0 111.121 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -77.78 -62.74 1.57 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.963 0.505 . . . . 0.0 111.461 -172.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.15 -50.89 17.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.911 0.485 . . . . 0.0 111.836 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.415 ' HD1' ' HA ' ' A' ' 69' ' ' LEU . 32.8 m-85 -91.92 -31.02 15.81 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.256 0.623 . . . . 0.0 111.689 -168.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.79 5.79 80.78 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.741 -173.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.639 HG21 HG12 ' A' ' 95' ' ' VAL . 88.3 t -77.11 87.68 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 122.106 0.955 . . . . 0.0 109.638 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.0 m -101.68 162.06 13.19 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 114.063 -1.426 . . . . 0.0 109.928 -177.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.84 38.85 93.26 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 123.503 0.502 . . . . 0.0 113.094 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.469 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 17.4 m -113.89 5.16 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.971 0.909 . . . . 0.0 111.443 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.59 -46.18 84.33 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.855 1.262 . . . . 0.0 112.723 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.48 -37.74 87.72 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.483 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.538 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 7.6 mp0 -66.69 -40.46 88.54 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.615 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 85.3 mt -59.98 -37.13 78.72 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.568 0.747 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.53 -38.63 87.57 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.059 174.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.03 -20.7 59.47 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.26 0.624 . . . . 0.0 111.719 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 95.5 mt -84.09 154.02 23.43 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.443 0.697 . . . . 0.0 112.066 -176.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 87' ' ' THR . 9.3 pt-20 -136.48 -37.61 0.69 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 109.196 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.516 HG22 ' HG3' ' A' ' 86' ' ' GLU . 11.9 p -102.56 143.28 32.46 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 125.675 1.59 . . . . 0.0 110.538 -173.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.3 t -77.81 -25.81 14.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.173 -173.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -64.81 -39.88 94.3 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.569 0.699 . . . . 0.0 109.854 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.492 ' HA ' HE21 ' A' ' 93' ' ' GLN . 3.9 mp0 -65.47 -36.27 83.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.921 173.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.459 HD22 ' SD ' ' A' ' 52' ' ' MET . 63.7 tp -66.4 -35.25 79.86 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.998 0.519 . . . . 0.0 111.397 172.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.461 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.5 m-85 -66.16 -51.73 55.05 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.285 0.634 . . . . 0.0 110.506 178.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.492 HE21 ' HA ' ' A' ' 90' ' ' GLU . 29.4 pt20 -70.08 -18.51 63.26 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.566 0.347 . . . . 0.0 111.513 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 85' ' ' LEU . 64.9 tp -68.99 -47.7 64.92 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.962 0.505 . . . . 0.0 110.614 171.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.639 HG12 HG21 ' A' ' 75' ' ' VAL . 75.9 t -64.56 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.53 0.732 . . . . 0.0 110.229 176.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.419 ' HB3' ' HA ' ' A' ' 93' ' ' GLN . 33.1 tt0 -60.94 -40.8 94.68 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.543 1.137 . . . . 0.0 110.688 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 6.6 tmtt? -63.58 -44.04 95.2 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.301 1.04 . . . . 0.0 109.71 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.8 -24.28 52.81 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.45 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -86.98 -39.05 16.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 123.339 0.399 . . . . 0.0 110.985 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.69 -56.64 4.26 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.461 0.704 . . . . 0.0 109.917 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 172.415 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 44.4 mt-10 -62.71 -56.84 14.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.697 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -58.82 -37.24 75.96 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 124.518 1.136 . . . . 0.0 111.752 -173.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -67.94 -45.45 74.25 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.275 0.63 . . . . 0.0 111.141 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -70.14 -28.62 65.51 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.412 HD12 HD11 ' A' ' 35' ' ' LEU . 9.4 tp -73.82 -27.04 60.91 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.269 1.028 . . . . 0.0 109.903 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.513 ' HA ' ' HG ' ' A' ' 36' ' ' SER . 63.4 m -70.32 -42.38 72.0 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.741 0.816 . . . . 0.0 109.606 173.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.54 -42.95 77.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.313 0.645 . . . . 0.0 110.525 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.412 HD11 HD12 ' A' ' 32' ' ' LEU . 90.1 mt -67.58 -39.67 84.84 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.11 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.513 ' HG ' ' HA ' ' A' ' 33' ' ' THR . 76.4 p -71.6 -29.33 64.57 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.843 0.457 . . . . 0.0 111.191 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -75.15 -40.07 43.77 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 C-N-CA 123.063 0.545 . . . . 0.0 110.312 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.44 -35.55 75.78 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.747 0.819 . . . . 0.0 112.023 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.496 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 78.1 p -91.81 -55.6 3.41 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.267 0.627 . . . . 0.0 110.766 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.61 -26.85 5.88 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.072 -175.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.67 148.75 66.34 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.347 0.659 . . . . 0.0 110.408 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.471 ' HD2' ' HG3' ' A' ' 45' ' ' GLU . 76.7 Cg_exo -53.55 159.21 6.73 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 123.396 2.731 . . . . 0.0 113.99 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.664 ' HZ3' ' HB2' ' A' ' 43' ' ' LYS . 8.8 mtmp? -60.42 -36.42 78.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.986 0.914 . . . . 0.0 110.692 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.02 -8.75 57.97 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.057 0.943 . . . . 0.0 112.046 -177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.471 ' HG3' ' HD2' ' A' ' 42' ' ' PRO . 34.6 mm-40 -90.89 -3.79 57.06 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.647 0.779 . . . . 0.0 110.743 170.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.4 mt -115.45 138.71 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.157 0.983 . . . . 0.0 109.323 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -133.77 161.98 33.23 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.007 0.923 . . . . 0.0 108.667 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.71 -34.6 78.21 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.8 -20.16 60.97 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.926 1.291 . . . . 0.0 112.445 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -74.05 155.99 37.95 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.263 1.025 . . . . 0.0 111.429 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -91.87 176.47 6.51 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.622 0.769 . . . . 0.0 110.326 173.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.465 ' HE1' ' HB2' ' A' ' 91' ' ' LEU . 55.3 mtt -110.58 111.97 23.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.687 0.795 . . . . 0.0 110.639 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -135.51 -53.33 0.77 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 174.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.95 -38.07 9.14 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.072 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.496 ' HA ' ' HB3' ' A' ' 39' ' ' SER . 56.5 mt -66.28 -43.14 87.21 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.552 -170.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.55 84.95 0.17 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.976 0.798 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -152.56 -48.23 0.1 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.319 0.248 . . . . 0.0 110.54 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.92 144.14 57.03 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.56 0.538 . . . . 0.0 110.048 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.7 p -55.7 -44.74 77.67 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 111.702 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.88 -40.03 94.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.688 0.795 . . . . 0.0 111.087 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 93.1 t -62.81 -43.5 98.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.03 0.532 . . . . 0.0 110.724 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.67 -30.83 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.031 0.933 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.0 m -66.46 -42.73 87.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.479 0.712 . . . . 0.0 110.108 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.41 -32.56 64.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.163 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.92 -46.18 82.74 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 0.0 110.317 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.0 p -70.61 -30.45 67.11 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.689 0.796 . . . . 0.0 111.028 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.54 -39.11 85.01 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.713 0.805 . . . . 0.0 109.619 173.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 5.9 mptp? -66.49 -44.12 83.53 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 123.521 0.728 . . . . 0.0 109.515 174.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.3 mt -64.0 -27.03 68.84 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.357 0.411 . . . . 0.0 111.259 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -49.49 77.62 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.434 0.693 . . . . 0.0 110.147 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -72.21 -43.39 64.53 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.377 -175.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 15.1 mm-40 -82.61 -52.32 6.92 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.693 0.797 . . . . 0.0 111.102 -168.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -126.31 0.57 7.04 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -171.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 70.47 6.47 58.39 Favored Glycine 0 N--CA 1.478 1.489 0 CA-C-O 119.777 -0.457 . . . . 0.0 114.031 -177.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 90.6 t -80.4 124.2 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.161 0.984 . . . . 0.0 110.674 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.2 m -149.0 155.72 41.21 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.715 0.806 . . . . 0.0 109.798 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.43 -18.2 57.47 Favored Glycine 0 C--N 1.348 1.223 0 CA-C-N 116.421 -0.354 . . . . 0.0 112.518 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.1 m -79.84 8.42 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 124.543 1.137 . . . . 0.0 112.144 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.35 -40.39 61.9 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.745 1.218 . . . . 0.0 112.145 -176.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.04 -46.3 81.87 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.978 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -68.66 -28.58 67.01 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.042 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.59 -37.8 77.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.103 0.961 . . . . 0.0 109.806 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.44 -32.25 73.79 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.255 174.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -79.18 -16.45 56.58 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.1 mt -70.75 138.45 50.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.586 0.354 . . . . 0.0 110.205 175.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -125.79 -11.53 6.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.531 0.732 . . . . 0.0 109.581 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.419 ' HB ' ' HG3' ' A' ' 90' ' ' GLU . 2.0 m -135.9 146.91 47.88 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 123.081 0.552 . . . . 0.0 109.979 -175.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.39 -30.32 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.267 -174.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -52.5 -49.12 65.39 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 123.48 0.488 . . . . 0.0 110.459 170.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.419 ' HG3' ' HB ' ' A' ' 87' ' ' THR . 47.4 mt-10 -61.16 -40.15 92.78 Favored 'General case' 0 C--N 1.35 0.6 0 O-C-N 124.499 1.124 . . . . 0.0 110.877 -176.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.465 ' HB2' ' HE1' ' A' ' 52' ' ' MET . 56.6 tp -62.73 -48.66 78.25 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.707 0.63 . . . . 0.0 111.785 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.436 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 9.3 m-85 -58.18 -39.1 78.04 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.485 0.49 . . . . 0.0 110.693 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -77.31 -31.83 54.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.662 0.601 . . . . 0.0 111.46 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.31 -55.38 8.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.18 0.592 . . . . 0.0 109.925 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.3 -43.92 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.482 1.113 . . . . 0.0 110.634 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -63.54 -40.93 98.29 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.973 0.796 . . . . 0.0 111.289 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.85 -29.39 66.62 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.201 0.6 . . . . 0.0 111.083 -177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -78.4 -36.97 45.07 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.626 0.77 . . . . 0.0 110.959 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.88 -37.42 55.55 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.512 1.125 . . . . 0.0 110.868 -176.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.76 -46.35 11.49 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.551 0.74 . . . . 0.0 109.902 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.222 0 C-N-CA 124.754 1.222 . . . . 0.0 112.305 175.487 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 CA-C-O 120.287 0.089 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -61.74 -40.03 93.65 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.29 0.994 . . . . 0.0 110.918 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.4 -43.09 95.49 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -69.03 -37.06 78.41 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.638 0.775 . . . . 0.0 110.801 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.2 tp -71.25 -39.39 71.64 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.289 0.636 . . . . 0.0 111.071 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.732 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 9.2 mp -69.0 -32.48 72.06 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.843 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.7 m -70.58 -34.35 72.09 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.696 0.399 . . . . 0.0 110.713 173.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.59 HG12 ' HB3' ' A' ' 68' ' ' LYS . 20.4 t -56.83 -46.87 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.361 0.664 . . . . 0.0 109.772 172.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -68.3 -36.68 79.71 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.962 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.3 p -68.33 -36.16 78.86 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.826 0.45 . . . . 0.0 111.751 -176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.3 -27.63 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.261 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.37 -41.72 63.06 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.162 0.585 . . . . 0.0 111.341 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.3 p -91.2 -63.07 1.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.468 0.707 . . . . 0.0 111.137 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.55 -38.58 1.56 Allowed Glycine 0 C--N 1.343 0.971 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -68.37 141.91 94.01 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.347 0.659 . . . . 0.0 110.368 175.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.434 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 56.6 Cg_endo -67.08 158.16 58.19 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.795 2.33 . . . . 0.0 111.639 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.732 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 20.5 pttm -68.15 -18.41 64.61 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.24 -31.11 65.2 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 124.226 1.011 . . . . 0.0 111.668 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.434 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 15.7 mm-40 -85.57 -23.98 27.41 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.865 0.866 . . . . 0.0 111.502 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -87.16 142.45 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 123.586 0.754 . . . . 0.0 111.051 -172.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.0 t -150.15 177.94 9.44 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.522 1.129 . . . . 0.0 109.195 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.7 mtt-85 -69.86 -24.7 63.47 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.87 0.468 . . . . 0.0 110.599 172.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -65.8 -32.39 73.9 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.102 0.876 . . . . 0.0 110.814 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.8 m -60.34 106.64 0.55 Allowed 'General case' 0 C--N 1.357 0.917 0 O-C-N 124.337 1.023 . . . . 0.0 110.551 -177.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.4 mtt-85 -81.4 155.48 25.88 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 169.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.8 mmt -69.68 90.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.789 0.68 . . . . 0.0 109.823 -176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -103.11 -18.09 15.1 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.276 1.03 . . . . 0.0 110.404 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -155.35 -47.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.949 1.3 . . . . 0.0 107.703 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.424 HD11 ' H ' ' A' ' 55' ' ' LEU . 1.6 mp -59.23 122.68 14.45 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.588 172.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.548 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . 53.75 21.88 2.9 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.098 0.959 . . . . 0.0 113.557 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -115.78 19.49 15.16 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 121.774 0.797 . . . . 0.0 111.41 -172.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -147.79 149.12 31.76 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 172.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.3 p -50.0 -42.65 49.53 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.972 1.309 . . . . 0.0 113.147 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.3 -38.19 74.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 110.87 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.2 t -76.15 -28.49 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.424 0.69 . . . . 0.0 111.304 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.503 HG12 ' HB2' ' A' ' 82' ' ' LEU . 60.1 t -73.07 -43.26 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 124.096 0.959 . . . . 0.0 109.456 175.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.4 t -60.96 -43.06 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.838 0.711 . . . . 0.0 110.053 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.65 -38.32 89.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.377 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.548 HD22 ' HB2' ' A' ' 56' ' ' ALA . 45.2 tp -64.23 -45.51 87.89 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 124.143 0.902 . . . . 0.0 110.521 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.6 t -65.44 -44.53 86.98 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.627 0.771 . . . . 0.0 111.292 -177.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.6 mt -67.53 -30.89 70.66 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.795 0.838 . . . . 0.0 111.219 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.59 ' HB3' HG12 ' A' ' 34' ' ' VAL . 5.5 tppt? -72.84 -46.24 54.02 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 123.79 0.681 . . . . 0.0 109.409 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 98.9 mt -62.73 -32.17 73.23 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.637 174.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -67.28 -30.16 69.95 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.627 1.171 . . . . 0.0 111.803 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -93.4 -48.95 6.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.833 0.453 . . . . 0.0 110.658 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -65.05 -53.86 39.23 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.992 0.807 . . . . 0.0 111.334 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -110.37 -23.5 11.15 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.421 0.688 . . . . 0.0 112.088 -172.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.34 13.91 64.91 Favored Glycine 0 N--CA 1.478 1.477 0 CA-C-N 117.739 0.245 . . . . 0.0 112.837 -172.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.603 HG21 HG13 ' A' ' 95' ' ' VAL . 96.4 t -91.6 115.88 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.41 0.684 . . . . 0.0 110.224 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 15.2 t -149.27 169.68 20.21 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 124.247 1.019 . . . . 0.0 109.598 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.48 -2.79 87.63 Favored Glycine 0 C--N 1.345 1.057 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.564 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 27.8 m -98.36 17.75 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.699 1.2 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.58 -53.56 29.53 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.296 1.438 . . . . 0.0 112.172 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.15 -39.68 87.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.03 -23.05 61.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.992 0.917 . . . . 0.0 111.233 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.503 ' HB2' HG12 ' A' ' 62' ' ' VAL . 81.7 mt -71.59 -33.48 69.09 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.404 0.682 . . . . 0.0 110.351 173.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -62.27 -40.23 95.53 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.602 0.564 . . . . 0.0 110.795 170.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.85 -24.07 63.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.322 0.649 . . . . 0.0 111.754 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.6 124.82 24.65 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 174.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -117.88 6.21 12.23 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.343 0.657 . . . . 0.0 109.324 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.7 p -145.38 143.44 30.11 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.893 0.877 . . . . 0.0 110.836 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.61 -32.09 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.646 172.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.72 -42.66 97.89 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.186 0.595 . . . . 0.0 111.633 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -27.79 63.63 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.502 0.321 . . . . 0.0 111.193 174.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -63.42 -38.65 91.96 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.346 0.258 . . . . 0.0 110.809 170.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -56.87 -58.44 8.14 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.399 0.679 . . . . 0.0 111.064 176.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -64.52 -29.7 70.73 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.826 0.704 . . . . 0.0 111.489 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.9 -56.71 10.39 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.517 0.511 . . . . 0.0 110.999 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.603 HG13 HG21 ' A' ' 75' ' ' VAL . 96.9 t -59.77 -48.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 O-C-N 123.73 0.644 . . . . 0.0 110.728 -177.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -65.22 -46.15 81.84 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.575 0.75 . . . . 0.0 112.869 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -65.06 -47.47 77.19 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.813 0.339 . . . . 0.0 110.41 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.48 -17.56 60.75 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.126 0.97 . . . . 0.0 111.968 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.518 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -80.79 -46.31 15.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.064 0.545 . . . . 0.0 109.91 176.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.1 -32.38 66.94 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.281 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.915 0 C-N-CA 124.765 1.226 . . . . 0.0 108.746 177.02 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.5 ptt? . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.537 -0.745 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -47.02 -63.2 1.1 Allowed 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -168.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.4 -26.22 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.302 0.641 . . . . 0.0 111.159 -178.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 m170 -75.52 -35.81 60.67 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.08 0.952 . . . . 0.0 111.018 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -77.73 -34.31 52.62 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.37 -31.43 71.66 Favored 'General case' 0 CA--C 1.559 1.323 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.138 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 m -67.53 -41.81 83.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.645 0.778 . . . . 0.0 110.717 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.66 -43.75 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.496 0.719 . . . . 0.0 110.788 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.16 -33.53 76.22 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.495 0.718 . . . . 0.0 111.199 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.408 ' HA ' HD11 ' A' ' 46' ' ' ILE . 32.2 t -64.38 -36.98 85.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.353 0.661 . . . . 0.0 111.22 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.41 -48.73 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.827 176.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.515 ' HB3' HG13 ' A' ' 61' ' ' VAL . . . -67.12 -29.34 69.04 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.161 0.985 . . . . 0.0 112.398 -171.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.5 p -91.15 -52.61 4.74 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.123 0.569 . . . . 0.0 109.518 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.29 -10.44 28.78 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.761 -175.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.0 m -80.61 156.91 72.85 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.212 0.605 . . . . 0.0 110.071 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.401 ' HG2' ' HG3' ' A' ' 45' ' ' GLU . 35.1 Cg_endo -63.46 155.9 59.7 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.281 1.987 . . . . 0.0 112.546 172.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -60.27 -23.31 64.03 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.286 1.034 . . . . 0.0 112.077 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -63.53 -38.07 89.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.209 1.003 . . . . 0.0 111.713 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.401 ' HG3' ' HG2' ' A' ' 42' ' ' PRO . 39.2 mt-10 -87.1 -0.9 57.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.451 0.7 . . . . 0.0 112.347 -174.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.549 HG21 HD13 ' A' ' 55' ' ' LEU . 44.1 mt -98.36 137.86 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.166 0.586 . . . . 0.0 109.937 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 t -144.38 151.8 39.79 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.302 0.641 . . . . 0.0 109.367 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.433 ' HD2' ' N ' ' A' ' 49' ' ' ASP . 5.0 ppt_? -62.78 -30.99 71.88 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 123.765 0.666 . . . . 0.0 109.667 167.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.433 ' N ' ' HD2' ' A' ' 48' ' ' ARG . 34.5 t70 -83.42 80.22 9.16 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 123.55 0.74 . . . . 0.0 109.148 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.4 t -165.27 147.5 7.81 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.698 -177.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -85.82 27.27 0.88 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.292 0.637 . . . . 0.0 110.462 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.659 ' SD ' ' HB2' ' A' ' 56' ' ' ALA . 15.6 mmt 68.11 36.22 3.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.63 1.172 . . . . 0.0 110.023 -165.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -59.26 88.2 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.39 1.076 . . . . 0.0 111.726 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 64.91 11.33 6.91 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.164 1.385 . . . . 0.0 112.024 -178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.549 HD13 HG21 ' A' ' 46' ' ' ILE . 83.9 mt -97.02 -40.96 8.6 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.553 0.741 . . . . 0.0 110.925 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.659 ' HB2' ' SD ' ' A' ' 52' ' ' MET . . . -158.51 -167.15 2.08 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.839 0.856 . . . . 0.0 109.984 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.4 t80 81.84 -27.51 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 125.829 1.652 . . . . 0.0 112.098 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.7 136.49 56.87 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.584 0.754 . . . . 0.0 109.947 167.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.0 m -52.61 -44.0 65.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 112.967 -173.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.2 tp -69.73 -38.43 76.87 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.88 0.472 . . . . 0.0 110.818 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.515 HG13 ' HB3' ' A' ' 38' ' ' ALA . 49.1 t -66.86 -37.5 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.711 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.6 t -67.88 -34.38 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 123.343 0.657 . . . . 0.0 110.463 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.1 m -61.85 -49.43 76.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.198 0.599 . . . . 0.0 110.264 175.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -66.91 -37.71 84.86 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.107 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.04 -43.64 78.23 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.774 0.829 . . . . 0.0 110.398 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.2 t -65.48 -43.01 91.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.42 0.688 . . . . 0.0 110.839 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.64 -36.58 84.29 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.124 0.89 . . . . 0.0 110.55 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -70.54 -50.93 32.42 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.334 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.25 -38.38 83.3 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.613 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -59.0 -53.96 52.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.156 0.982 . . . . 0.0 112.17 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -84.91 -62.94 1.42 Allowed 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.818 0.342 . . . . 0.0 110.888 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -65.69 -47.76 74.36 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.008 0.923 . . . . 0.0 112.218 -166.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -91.2 -20.77 21.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.137 0.575 . . . . 0.0 111.813 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.55 0.57 89.38 Favored Glycine 0 C--N 1.352 1.429 0 N-CA-C 113.87 0.308 . . . . 0.0 113.87 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.88 108.82 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 124.286 1.034 . . . . 0.0 109.941 -177.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -133.27 166.47 22.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.155 0.582 . . . . 0.0 110.584 -176.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.29 18.02 79.76 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-N 116.334 -0.394 . . . . 0.0 112.475 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.9 m -110.42 15.79 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.484 1.114 . . . . 0.0 110.614 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.22 -45.24 88.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.709 1.204 . . . . 0.0 111.939 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -68.35 -36.47 79.28 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.694 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.95 -27.96 64.12 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.188 0.595 . . . . 0.0 111.199 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 99.3 mt -74.32 -26.88 60.43 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.51 0.724 . . . . 0.0 110.853 175.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.11 -37.31 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.184 171.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.86 16.35 3.4 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.096 0.958 . . . . 0.0 112.636 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.23 127.32 32.66 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.013 0.435 . . . . 0.0 111.231 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -93.07 -58.65 2.25 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.344 176.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.0 p -119.65 169.34 10.18 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.477 HG22 ' SD ' ' A' ' 52' ' ' MET . 47.6 t -70.07 -33.38 54.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.685 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.64 -40.01 90.38 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.031 0.933 . . . . 0.0 110.611 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -58.78 -43.13 90.33 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.357 1.063 . . . . 0.0 110.54 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 44.0 tp -61.37 -46.09 91.65 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.485 0.714 . . . . 0.0 111.945 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -58.73 -42.96 89.94 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 123.377 0.423 . . . . 0.0 111.081 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.28 -37.53 83.56 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.823 0.449 . . . . 0.0 111.481 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.51 -57.75 10.05 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.374 0.67 . . . . 0.0 110.903 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.15 -35.37 71.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.448 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.98 -45.04 90.82 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.206 1.002 . . . . 0.0 111.473 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -65.57 -41.3 93.09 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.807 -178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -79.97 -17.53 52.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.337 0.655 . . . . 0.0 111.975 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -72.22 -44.88 62.26 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.743 0.817 . . . . 0.0 109.453 174.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.29 -66.26 0.87 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.062 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.492 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.283 176.136 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.7 tmm? . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -65.61 -62.97 1.21 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.391 0.677 . . . . 0.0 112.395 -166.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.85 -34.81 73.61 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.652 0.781 . . . . 0.0 110.85 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -68.58 -35.55 77.53 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.466 0.706 . . . . 0.0 111.636 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.491 HD22 ' HG ' ' A' ' 91' ' ' LEU . 59.2 tp -71.7 -36.6 70.6 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 tp -61.76 -36.93 82.46 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.918 0.887 . . . . 0.0 110.623 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 m -70.43 -40.0 74.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.837 0.855 . . . . 0.0 110.405 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.6 t -60.56 -38.79 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.902 0.881 . . . . 0.0 110.538 176.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.527 HD23 HD21 ' A' ' 91' ' ' LEU . 95.9 mt -72.62 -33.95 67.01 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.753 0.821 . . . . 0.0 111.287 177.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.1 t -60.85 -38.09 84.34 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.468 0.48 . . . . 0.0 110.694 176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.3 t -79.61 -37.14 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.686 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.56 71.52 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 0.0 111.979 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m -88.7 -40.33 13.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.595 0.758 . . . . 0.0 110.471 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.36 -32.02 7.36 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.0 -175.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.5 m -73.84 143.63 81.6 Favored Pre-proline 0 CA--C 1.556 1.189 0 C-N-CA 123.583 0.753 . . . . 0.0 110.233 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.93 168.9 8.12 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.849 2.366 . . . . 0.0 113.532 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -63.39 -25.71 68.41 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.984 0.913 . . . . 0.0 112.149 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -69.07 -27.91 66.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.384 1.074 . . . . 0.0 110.854 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -76.83 -23.09 52.77 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.823 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.581 HG22 HD13 ' A' ' 55' ' ' LEU . 21.2 mt -109.0 144.24 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.749 0.819 . . . . 0.0 110.222 -173.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.7 t -156.07 170.8 21.35 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.012 1.325 . . . . 0.0 108.135 174.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -62.27 -32.66 73.4 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.97 0.508 . . . . 0.0 110.417 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -95.04 -1.65 51.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.421 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.3 m -71.74 -6.15 39.2 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.028 0.531 . . . . 0.0 112.339 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 72.4 mtp85 68.47 170.45 0.28 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.872 1.269 . . . . 0.0 112.638 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.76 ' HG3' ' HB2' ' A' ' 57' ' ' PHE . 44.7 tpp -112.63 90.88 3.46 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.181 -172.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 57' ' ' PHE . 10.3 tp10 -109.84 -68.73 0.9 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.139 0.976 . . . . 0.0 109.921 176.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -116.18 -18.47 10.57 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.95 0.9 . . . . 0.0 110.824 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.581 HD13 HG22 ' A' ' 46' ' ' ILE . 84.3 mt -60.95 -32.75 72.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.268 1.027 . . . . 0.0 112.842 -171.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.504 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . -163.37 13.96 0.06 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.393 0.677 . . . . 0.0 112.072 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.76 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 81.6 t80 -100.17 -32.22 11.01 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.538 0.335 . . . . 0.0 110.936 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -55.6 133.43 50.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.901 -0.571 . . . . 0.0 109.568 176.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.8 t -52.95 -37.86 61.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.371 1.069 . . . . 0.0 113.022 -170.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 53.1 tp -68.46 -43.98 75.83 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 123.48 0.488 . . . . 0.0 110.492 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.69 -28.53 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.4 t -67.34 -49.14 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.258 0.623 . . . . 0.0 110.241 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.9 m -63.59 -40.14 96.18 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 124.022 0.826 . . . . 0.0 110.718 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -67.14 -41.09 86.66 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.112 0.965 . . . . 0.0 111.051 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.504 HD22 ' HB2' ' A' ' 56' ' ' ALA . 35.0 tp -67.66 -48.87 65.44 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 123.453 0.47 . . . . 0.0 110.209 -175.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.0 t -64.22 -32.71 74.4 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.796 0.438 . . . . 0.0 110.742 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.5 -52.36 61.58 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.243 1.017 . . . . 0.0 109.955 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.1 OUTLIER -74.09 -42.67 59.77 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.572 -173.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 60.8 mt -61.43 -28.99 69.66 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.101 176.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -57.16 -32.09 66.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.232 1.013 . . . . 0.0 111.681 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HZ1' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER -97.14 -50.83 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.773 0.829 . . . . 0.0 111.046 177.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 25.4 mm-40 -62.28 -53.02 61.1 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.379 1.072 . . . . 0.0 112.226 -171.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -120.53 -4.36 9.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.219 0.607 . . . . 0.0 111.822 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.64 20.06 79.77 Favored Glycine 0 C--N 1.351 1.392 0 C-N-CA 123.364 0.507 . . . . 0.0 114.146 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 51.0 t -90.93 117.41 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.704 0.802 . . . . 0.0 109.532 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.8 m -145.41 150.25 36.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.008 0.923 . . . . 0.0 110.672 -171.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.41 15.8 78.96 Favored Glycine 0 C--N 1.359 1.825 0 O-C-N 123.555 0.534 . . . . 0.0 112.861 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.22 8.19 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.328 1.051 . . . . 0.0 111.055 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -54.0 -43.04 69.72 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 125.206 1.403 . . . . 0.0 112.29 -173.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.3 -43.77 96.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 113.765 -1.561 . . . . 0.0 110.051 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.44 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 30.5 tt0 -73.43 -28.89 62.22 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.721 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.442 HD23 HD12 ' A' ' 94' ' ' LEU . 93.0 mt -62.8 -37.97 88.82 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.077 0.951 . . . . 0.0 110.265 176.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.29 -39.03 75.1 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.036 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.78 -14.21 62.88 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.56 HD13 HD12 ' A' ' 94' ' ' LEU . 57.7 mt -70.82 123.2 21.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.887 0.475 . . . . 0.0 110.451 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.496 ' HG3' HG22 ' A' ' 87' ' ' THR . 10.7 pt-20 -93.12 -22.78 18.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.583 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 67.5 p -133.81 159.14 41.53 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.571 0.748 . . . . 0.0 111.122 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 t -69.22 -26.89 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.116 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' ' 93' ' ' GLN . 33.0 t70 -61.11 -43.91 98.16 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.191 0.596 . . . . 0.0 110.408 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.41 ' HB3' HD22 ' A' ' 85' ' ' LEU . 74.0 mm-40 -60.62 -32.38 71.52 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 123.882 0.739 . . . . 0.0 111.545 172.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.527 HD21 HD23 ' A' ' 35' ' ' LEU . 34.0 tp -67.83 -41.41 83.07 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 175.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -60.8 -40.37 92.42 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.956 0.408 . . . . 0.0 109.927 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 89' ' ' ASP . 76.7 mt-30 -64.1 -40.41 96.17 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.117 174.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.56 HD12 HD13 ' A' ' 85' ' ' LEU . 6.1 tt -59.64 -49.94 75.8 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.264 1.026 . . . . 0.0 110.907 -176.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.502 HG11 HG22 ' A' ' 75' ' ' VAL . 63.3 t -62.87 -50.81 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -65.11 -24.26 67.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 123.816 0.698 . . . . 0.0 112.435 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -67.33 -51.59 50.57 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.24 1.016 . . . . 0.0 109.854 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -82.49 -16.56 48.32 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.402 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -41.4 28.25 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.22 1.008 . . . . 0.0 109.33 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.35 -51.78 9.59 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.47 0.708 . . . . 0.0 110.677 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 176.596 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.422 ' HA ' ' HE1' ' A' ' 92' ' ' PHE . 51.3 mt-10 -59.93 -53.03 62.69 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 123.347 0.659 . . . . 0.0 110.492 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.83 -34.79 78.97 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.241 -179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -64.11 -38.26 90.43 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.409 0.683 . . . . 0.0 111.867 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.47 HD23 HG21 ' A' ' 95' ' ' VAL . 58.3 mt -69.16 -38.55 78.79 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.175 0.512 . . . . 0.0 111.016 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tp -67.86 -37.39 81.77 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.952 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.6 m -76.13 -37.51 57.93 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.653 1.181 . . . . 0.0 110.936 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.406 HG11 ' HA ' ' A' ' 31' ' ' LEU . 11.7 p -68.96 -35.4 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 117.78 0.264 . . . . 0.0 110.614 -176.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.64 -39.74 84.6 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.543 173.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.1 t -59.65 -51.73 68.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.678 0.791 . . . . 0.0 111.733 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.4 t -71.04 -45.8 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 123.958 0.903 . . . . 0.0 111.335 -174.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.32 80.48 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.045 0.538 . . . . 0.0 111.627 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.6 m -85.93 -15.89 40.21 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.933 0.493 . . . . 0.0 111.666 178.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.02 6.73 89.02 Favored Glycine 0 C--N 1.352 1.468 0 C-N-CA 122.739 0.209 . . . . 0.0 113.495 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.704 HG22 HD21 ' A' ' 55' ' ' LEU . 27.1 m -88.44 161.52 42.37 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 124.923 1.289 . . . . 0.0 111.003 -178.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.23 149.03 92.11 Favored 'Trans proline' 0 C--N 1.367 1.529 0 C-N-CA 122.416 2.077 . . . . 0.0 111.36 162.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -70.04 -19.26 63.31 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.239 0.616 . . . . 0.0 110.53 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.37 -27.46 64.25 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.132 0.973 . . . . 0.0 112.65 172.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.83 -16.85 61.6 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.89 0.876 . . . . 0.0 111.454 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.13 125.19 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.666 0.786 . . . . 0.0 111.081 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.3 t -125.8 177.11 6.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.438 1.095 . . . . 0.0 108.066 168.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -68.52 -39.08 81.34 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 122.559 0.344 . . . . 0.0 110.982 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.36 -3.68 58.44 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.8 0.84 . . . . 0.0 112.025 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -72.36 164.69 25.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.229 0.612 . . . . 0.0 111.986 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.646 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 0.0 OUTLIER -110.38 132.39 54.22 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.377 0.608 . . . . 0.0 110.361 173.355 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.9 ptp -80.68 67.71 6.65 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 122.339 1.066 . . . . 0.0 109.104 171.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -86.14 -70.77 0.58 Allowed 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.54 -30.99 67.88 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 172.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.704 HD21 HG22 ' A' ' 41' ' ' VAL . 2.7 mp -91.07 140.52 29.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.592 1.157 . . . . 0.0 108.965 -173.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 74.61 -37.32 0.35 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 170.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -63.53 -29.35 70.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.673 1.189 . . . . 0.0 113.726 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.11 135.88 48.75 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.491 0.717 . . . . 0.0 110.7 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 m -60.84 -33.08 72.5 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -171.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.17 -37.83 75.28 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.193 0.597 . . . . 0.0 109.964 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -72.57 -38.03 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.839 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.5 t -65.19 -34.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 C-N-CA 123.807 0.843 . . . . 0.0 110.328 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.4 t -62.68 -49.13 76.31 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.288 0.635 . . . . 0.0 109.82 178.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 9.1 tp10 -67.33 -41.88 84.53 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.172 0.589 . . . . 0.0 110.513 178.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.56 -44.46 96.99 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.678 1.191 . . . . 0.0 111.147 -177.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.6 p -65.79 -36.17 82.76 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.667 0.787 . . . . 0.0 110.991 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 96.9 mt -63.92 -40.6 96.85 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.913 0.758 . . . . 0.0 111.097 173.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 75.1 mmtt -67.58 -44.04 79.11 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.002 0.521 . . . . 0.0 111.076 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.5 mt -67.32 -35.68 79.91 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.582 0.353 . . . . 0.0 110.172 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -60.69 -39.37 88.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.958 1.303 . . . . 0.0 111.419 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' LEU . 74.2 mmtt -91.64 -68.06 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.926 0.49 . . . . 0.0 110.773 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -63.0 -42.66 99.91 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.249 1.02 . . . . 0.0 112.472 -169.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -98.08 -20.98 17.03 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.147 0.579 . . . . 0.0 111.041 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.89 -7.92 68.42 Favored Glycine 0 C--N 1.353 1.515 0 CA-C-O 119.893 -0.393 . . . . 0.0 113.16 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.469 HG21 HG11 ' A' ' 95' ' ' VAL . 68.9 t -75.75 98.4 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 124.534 1.133 . . . . 0.0 110.021 -175.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.7 m -109.17 154.86 21.76 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.485 1.114 . . . . 0.0 110.271 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.37 20.32 72.32 Favored Glycine 0 C--N 1.351 1.409 0 C-N-CA 123.251 0.453 . . . . 0.0 113.392 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 m -108.96 16.08 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.639 0.776 . . . . 0.0 110.982 -177.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.48 -56.89 14.96 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.099 1.359 . . . . 0.0 111.292 -175.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.33 -34.97 79.38 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.679 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -68.09 -30.69 69.92 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.636 0.775 . . . . 0.0 110.528 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 96.6 mt -70.4 -39.69 74.34 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.081 0.952 . . . . 0.0 110.96 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.62 -35.41 76.1 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.852 173.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.92 -19.99 53.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.5 0.72 . . . . 0.0 112.19 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.521 HD13 HD11 ' A' ' 94' ' ' LEU . 69.8 mt -67.88 138.65 56.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 117.95 0.341 . . . . 0.0 111.398 176.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -119.54 -38.07 3.05 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 123.364 0.665 . . . . 0.0 109.601 177.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.646 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 50.8 p -108.19 148.06 30.46 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 122.119 0.961 . . . . 0.0 112.164 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.427 HG11 ' CE2' ' A' ' 92' ' ' PHE . 34.0 t -65.71 -30.11 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 113.987 -1.46 . . . . 0.0 109.834 176.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.4 -46.49 80.15 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.067 0.947 . . . . 0.0 111.169 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.02 -32.99 74.73 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.264 176.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.98 -48.64 79.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 123.639 0.587 . . . . 0.0 111.902 174.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CE2' HG11 ' A' ' 88' ' ' VAL . 64.3 m-85 -56.29 -45.09 80.33 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.235 0.614 . . . . 0.0 110.902 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.543 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 48.6 mt-30 -64.52 -49.24 72.07 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.944 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.521 HD11 HD13 ' A' ' 85' ' ' LEU . 8.5 tt -51.72 -57.85 8.08 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.053 1.341 . . . . 0.0 110.378 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.47 HG21 HD23 ' A' ' 31' ' ' LEU . 70.8 t -58.84 -38.75 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.657 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.5 -36.25 78.64 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.17 0.588 . . . . 0.0 111.906 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 34.3 mmtp -66.49 -39.26 88.64 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.214 0.606 . . . . 0.0 110.127 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -78.62 -24.69 45.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.134 0.574 . . . . 0.0 111.208 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -77.62 -32.31 53.37 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.362 0.665 . . . . 0.0 110.64 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.56 -62.12 1.32 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.674 0.79 . . . . 0.0 111.105 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.638 -171.829 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' HD23 ' A' ' 32' ' ' LEU . 35.5 mt-10 -53.82 -48.63 69.72 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 123.941 0.896 . . . . 0.0 111.122 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.06 -47.05 78.67 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.159 0.912 . . . . 0.0 111.28 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.435 ' O ' HG21 ' A' ' 34' ' ' VAL . 55.4 t60 -73.19 -25.95 60.98 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.619 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.46 -40.02 85.33 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 0.9 OUTLIER -60.89 -40.48 93.22 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.513 0.325 . . . . 0.0 110.202 171.435 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -63.59 -37.99 89.41 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.556 0.742 . . . . 0.0 110.978 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 30' ' ' HIS . 61.1 t -62.61 -50.75 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 122.801 0.441 . . . . 0.0 109.852 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.74 -42.33 95.27 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 122.697 0.399 . . . . 0.0 111.593 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.2 p -64.69 -39.6 93.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.563 0.745 . . . . 0.0 111.96 -174.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.56 -31.33 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.293 175.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.97 -7.71 59.04 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 0.0 112.509 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -112.31 -61.54 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.426 0.69 . . . . 0.0 109.987 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.12 -34.42 2.26 Favored Glycine 0 C--N 1.341 0.84 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.292 -173.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.19 154.87 92.08 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 123.19 0.596 . . . . 0.0 111.1 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -55.23 152.57 30.75 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 123.008 2.472 . . . . 0.0 113.27 168.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.579 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 21.4 ptmt -69.71 -22.81 63.37 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.599 0.76 . . . . 0.0 111.817 -179.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -73.21 -25.4 60.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.336 0.654 . . . . 0.0 110.505 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -72.95 -18.58 61.37 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.446 0.698 . . . . 0.0 111.593 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.0 mt -102.19 124.23 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.312 0.645 . . . . 0.0 109.704 -177.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -133.42 -179.88 5.79 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.297 1.039 . . . . 0.0 108.723 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.504 ' HB3' ' HB2' ' A' ' 89' ' ' ASP . 5.5 mpt_? -58.85 -55.12 39.2 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.004 0.922 . . . . 0.0 111.585 -172.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -90.47 3.92 52.53 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 0.0 112.343 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.5 m -74.48 -0.76 18.55 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.602 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 49.7 mtt180 66.81 170.74 0.25 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 112.259 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.714 ' SD ' HD21 ' A' ' 91' ' ' LEU . 72.5 mtm -116.45 29.54 7.89 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.231 1.013 . . . . 0.0 108.973 168.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.98 -55.83 30.11 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.207 0.942 . . . . 0.0 110.795 -172.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -101.72 16.21 26.53 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.972 0.909 . . . . 0.0 110.568 177.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 74.4 mt -114.34 -68.14 0.95 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.842 0.457 . . . . 0.0 111.615 -171.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -112.24 -21.4 11.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -173.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -70.6 89.65 0.73 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.162 0.585 . . . . 0.0 110.32 -176.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -177.62 146.97 0.48 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.616 1.566 . . . . 0.0 108.213 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -56.49 -46.6 80.41 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.386 0.674 . . . . 0.0 112.049 -177.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.41 -37.84 63.24 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.022 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.19 -32.8 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.218 0.324 . . . . 0.0 111.736 -175.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.5 -37.42 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 171.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 70.7 m -67.25 -37.28 83.24 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.013 0.525 . . . . 0.0 111.272 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.43 -37.2 65.94 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.7 tp -66.68 -48.11 70.34 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.472 ' HB3' HD13 ' A' ' 82' ' ' LEU . 40.8 p -66.62 -33.23 75.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.216 0.607 . . . . 0.0 111.665 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 56.2 tp -69.31 -40.4 77.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.348 0.659 . . . . 0.0 110.516 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -71.99 -42.09 66.87 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.392 0.677 . . . . 0.0 110.39 -177.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.451 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 93.3 mt -66.57 -38.55 87.31 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.052 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -55.27 -45.08 76.16 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.582 1.153 . . . . 0.0 111.516 177.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.7 -66.51 0.69 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.762 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.94 -54.49 6.5 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.043 -165.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -89.5 -11.68 42.23 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.454 -174.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.57 -7.6 53.03 Favored Glycine 0 C--N 1.355 1.612 0 C-N-CA 123.836 0.731 . . . . 0.0 114.393 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.451 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 48.5 t -77.56 102.79 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.84 0.856 . . . . 0.0 110.777 -171.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 t -137.32 169.36 17.92 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.695 0.798 . . . . 0.0 110.313 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.01 14.62 78.7 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.538 -176.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.422 HG22 HG12 ' A' ' 75' ' ' VAL . 35.7 m -119.91 16.17 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.429 1.092 . . . . 0.0 111.274 -173.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -54.94 -44.76 74.58 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.04 0.936 . . . . 0.0 112.216 -173.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -67.07 -34.09 76.92 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.458 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.465 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.3 mp0 -67.43 -38.5 84.66 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.668 0.605 . . . . 0.0 110.381 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 66' ' ' SER . 97.7 mt -63.91 -31.47 72.66 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.333 0.653 . . . . 0.0 111.197 178.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -75.1 -35.02 61.8 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.512 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -69.84 -23.46 63.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.631 0.772 . . . . 0.0 111.384 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.551 HD12 HD13 ' A' ' 94' ' ' LEU . 95.1 mt -76.31 118.11 18.68 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 122.938 0.495 . . . . 0.0 110.475 178.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.87 -13.76 19.92 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.682 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.602 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -137.55 144.09 41.91 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 124.086 0.954 . . . . 0.0 111.477 -168.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.7 t -75.23 -23.66 17.2 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.06 -171.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.504 ' HB2' ' HB3' ' A' ' 48' ' ' ARG . 31.7 t70 -59.62 -50.06 75.36 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.452 0.644 . . . . 0.0 110.239 178.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -68.02 -31.56 71.32 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.319 -1.31 . . . . 0.0 110.556 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.714 HD21 ' SD ' ' A' ' 52' ' ' MET . 52.5 tp -64.33 -47.29 79.92 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 123.406 0.441 . . . . 0.0 111.586 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -56.73 -45.96 81.64 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.599 0.76 . . . . 0.0 109.881 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.78 -34.06 74.92 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.863 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.551 HD13 HD12 ' A' ' 85' ' ' LEU . 9.4 tt -70.32 -47.03 62.96 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.62 -48.69 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 123.42 0.688 . . . . 0.0 110.057 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.71 -36.34 80.45 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.602 0.761 . . . . 0.0 111.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -64.43 -48.65 74.54 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.306 0.642 . . . . 0.0 110.5 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -77.37 -18.45 57.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.695 0.798 . . . . 0.0 111.499 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -78.44 -46.46 19.73 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.482 0.713 . . . . 0.0 110.282 176.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.51 -62.27 1.58 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.36 0.664 . . . . 0.0 109.901 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.907 179.103 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.499 ' HE2' HG13 ' A' ' 95' ' ' VAL . 20.1 ttt . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.87 -58.73 6.39 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.121 0.568 . . . . 0.0 110.555 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -62.09 -31.55 72.01 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.17 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.403 ' O ' HG22 ' A' ' 34' ' ' VAL . 5.1 t60 -71.91 -31.68 66.63 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.63 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.3 -37.56 85.69 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.896 0.478 . . . . 0.0 109.713 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -65.09 -35.9 82.61 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.751 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.5 m -66.53 -41.66 88.44 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.238 0.615 . . . . 0.0 110.069 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 30' ' ' HIS . 43.9 t -58.76 -47.04 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.069 0.948 . . . . 0.0 110.294 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.526 ' HB3' HD22 ' A' ' 55' ' ' LEU . 98.2 mt -68.35 -37.69 80.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.342 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.7 t -64.6 -39.52 93.87 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.085 0.954 . . . . 0.0 111.253 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 65.7 t -78.7 -30.54 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.379 0.672 . . . . 0.0 110.201 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.93 -25.95 53.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.316 0.646 . . . . 0.0 112.156 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.5 p -108.26 -66.11 1.07 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.002 0.521 . . . . 0.0 110.151 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.06 -27.04 2.81 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-O 119.847 -0.418 . . . . 0.0 112.163 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.05 131.66 88.85 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.967 0.507 . . . . 0.0 110.813 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.66 158.82 26.53 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 123.304 2.669 . . . . 0.0 112.478 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -63.12 -21.1 65.96 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.719 0.808 . . . . 0.0 112.51 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -65.83 -26.16 67.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.765 0.826 . . . . 0.0 111.335 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -100.29 8.27 43.84 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.885 0.874 . . . . 0.0 111.914 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.487 HG12 HD21 ' A' ' 55' ' ' LEU . 38.4 mt -113.14 140.08 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.188 0.595 . . . . 0.0 109.876 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -151.55 173.33 14.75 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.517 1.127 . . . . 0.0 109.366 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -30.25 69.92 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.463 0.649 . . . . 0.0 110.0 169.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.39 15.58 10.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.526 1.13 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.503 ' HB3' HG21 ' A' ' 88' ' ' VAL . 47.9 t -70.22 -21.38 63.02 Favored 'General case' 0 C--N 1.358 0.976 0 O-C-N 122.052 -0.405 . . . . 0.0 110.452 171.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 56.45 23.18 7.19 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.834 1.253 . . . . 0.0 113.404 169.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.6 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 14.3 mmt 60.4 54.58 3.82 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.195 0.998 . . . . 0.0 111.928 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 50' ' ' SER . 20.0 mm-40 -68.8 -71.31 0.22 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.179 0.514 . . . . 0.0 110.208 177.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.03 -19.99 14.01 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.915 1.286 . . . . 0.0 109.837 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 35' ' ' LEU . 4.4 mp -93.15 133.12 36.65 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.21 1.004 . . . . 0.0 110.357 -168.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.6 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 68.38 -69.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.861 1.664 . . . . 0.0 112.051 176.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.548 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 43.9 t80 -56.79 90.84 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.342 1.457 . . . . 0.0 111.776 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.1 t70 176.14 146.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 106.513 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 56.2 p -56.84 -45.48 82.34 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.054 0.542 . . . . 0.0 112.271 -175.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.6 tp -70.37 -49.08 52.92 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.279 0.632 . . . . 0.0 110.867 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 18.5 t -71.53 -26.45 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 123.43 0.457 . . . . 0.0 111.322 -172.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.91 -43.96 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.506 0.722 . . . . 0.0 109.646 172.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.1 m -62.27 -36.5 82.25 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.468 0.651 . . . . 0.0 111.122 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.545 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 25.6 tt0 -75.22 -37.84 60.93 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.306 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 35.1 tp -65.47 -28.45 69.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.319 0.648 . . . . 0.0 110.673 176.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 58.2 m -63.07 -49.48 74.36 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.097 0.959 . . . . 0.0 110.553 175.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -75.19 -19.94 59.56 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 119.217 -0.421 . . . . 0.0 112.126 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 72.9 mmtt -64.43 -62.88 1.32 Allowed 'General case' 0 C--N 1.367 1.365 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.63 -30.46 69.88 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.524 1.129 . . . . 0.0 111.802 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -52.9 -49.24 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.913 1.285 . . . . 0.0 110.451 173.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -91.42 -24.5 19.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.52 0.728 . . . . 0.0 111.722 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -85.64 -52.98 5.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.821 0.848 . . . . 0.0 111.571 -166.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -117.58 -2.19 11.52 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.365 0.666 . . . . 0.0 110.848 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.5 -3.88 83.56 Favored Glycine 0 C--N 1.353 1.515 0 C-N-CA 122.992 0.329 . . . . 0.0 113.409 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.0 t -89.36 98.44 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.8 t -80.17 143.66 33.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.177 0.591 . . . . 0.0 112.336 -169.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.32 -87.22 0.5 Allowed Glycine 0 C--N 1.351 1.377 0 O-C-N 124.287 0.992 . . . . 0.0 112.872 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.571 HG13 ' HB3' ' A' ' 81' ' ' GLU . 3.5 t 62.3 21.93 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 C-N-CA 124.518 1.127 . . . . 0.0 110.032 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.07 -41.22 74.77 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.814 1.246 . . . . 0.0 112.663 -168.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -62.08 -44.87 95.73 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 123.875 0.734 . . . . 0.0 111.009 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.571 ' HB3' HG13 ' A' ' 78' ' ' VAL . 8.4 tp10 -72.61 -47.88 44.15 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.186 -175.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.87 -30.61 70.98 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.971 0.908 . . . . 0.0 111.475 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.76 -44.89 80.21 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.508 0.723 . . . . 0.0 110.476 171.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -71.57 -27.75 63.37 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.901 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 80.0 mt -66.67 111.98 3.95 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.384 0.611 . . . . 0.0 110.791 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -100.52 -22.07 15.12 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.285 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.96 149.22 50.43 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.377 0.671 . . . . 0.0 111.286 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.503 HG21 ' HB3' ' A' ' 50' ' ' SER . 45.0 t -66.0 -28.42 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.218 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 17.7 t70 -60.04 -41.46 92.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 122.761 0.424 . . . . 0.0 110.559 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.44 -29.9 69.49 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.23 0.612 . . . . 0.0 111.625 175.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.409 HD23 ' HE3' ' A' ' 52' ' ' MET . 69.3 tp -64.74 -39.37 93.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.557 0.343 . . . . 0.0 110.623 171.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.72 -41.07 98.14 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.773 0.429 . . . . 0.0 110.522 174.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 73.6 mm-40 -62.45 -42.13 99.24 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.817 0.447 . . . . 0.0 110.509 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.553 HD12 ' HG2' ' A' ' 81' ' ' GLU . 42.3 tp -59.65 -61.01 2.94 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.057 0.943 . . . . 0.0 110.897 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.499 HG13 ' HE2' ' A' ' 27' ' ' MET . 87.7 t -64.44 -40.75 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.151 0.581 . . . . 0.0 111.099 -172.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.472 ' HA ' ' HE1' ' A' ' 27' ' ' MET . 1.2 tm-20 -68.02 -53.57 24.91 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.52 0.728 . . . . 0.0 110.246 -176.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -66.51 -36.07 81.8 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.396 0.678 . . . . 0.0 111.707 -174.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 -84.7 -22.53 29.73 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.45 ' NH1' ' SD ' ' A' ' 27' ' ' MET . 46.5 ttt180 -74.62 -37.85 62.71 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.46 -51.88 52.1 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.791 0.837 . . . . 0.0 110.244 172.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 126.464 1.906 . . . . 0.0 112.118 -178.872 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.5 tmm? . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.19 -61.83 2.1 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 124.054 0.846 . . . . 0.0 111.721 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.561 ' HA ' HD21 ' A' ' 32' ' ' LEU . 30.5 t70 -69.85 -24.69 63.48 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.881 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -65.77 -33.45 75.9 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.429 0.692 . . . . 0.0 110.477 170.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.433 HD21 HD21 ' A' ' 91' ' ' LEU . 10.4 tt -68.8 -37.05 78.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.071 0.548 . . . . 0.0 110.079 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' A' ' 29' ' ' ASP . 2.6 mm? -62.77 -34.98 78.38 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 123.03 0.206 . . . . 0.0 111.144 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -63.22 -42.22 99.24 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.457 0.703 . . . . 0.0 110.609 176.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.495 HG12 ' HG2' ' A' ' 68' ' ' LYS . 41.4 t -63.82 -43.07 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.38 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.02 -39.44 93.4 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.049 0.54 . . . . 0.0 111.484 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.5 p -68.15 -31.56 71.22 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.484 0.49 . . . . 0.0 111.682 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.8 t -75.04 -39.87 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.058 0 C-N-CA 122.876 0.47 . . . . 0.0 110.155 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.58 -29.94 62.71 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.649 0.78 . . . . 0.0 112.244 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.6 p -94.42 -53.78 3.78 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.192 0.597 . . . . 0.0 110.147 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.55 -15.04 9.89 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.951 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.8 m -92.67 145.72 30.9 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.363 0.665 . . . . 0.0 110.523 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -51.25 158.16 3.83 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.836 3.024 . . . . 0.0 115.162 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -63.35 -22.83 67.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.473 1.109 . . . . 0.0 111.984 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.42 -29.21 68.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.785 0.434 . . . . 0.0 111.147 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.62 0.56 56.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.601 0.761 . . . . 0.0 111.0 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.44 HG21 HD11 ' A' ' 32' ' ' LEU . 34.9 mt -129.82 105.96 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 123.674 0.789 . . . . 0.0 110.751 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.8 t -110.72 -177.77 3.31 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.737 0.815 . . . . 0.0 109.172 170.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.9 ptp85 -67.11 -33.36 75.3 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 173.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -70.43 -19.48 62.98 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.235 1.014 . . . . 0.0 111.3 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 m -66.44 149.23 50.73 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.873 0.844 . . . . 0.0 111.499 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.543 ' HD3' HG22 ' A' ' 87' ' ' THR . 16.4 mmt180 -82.98 -161.45 0.49 Allowed 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.183 178.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 49.5 mtt -130.99 -2.61 4.04 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.94 -10.92 23.98 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 118.833 0.742 . . . . 0.0 112.698 -173.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -141.88 26.57 1.88 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.746 0.818 . . . . 0.0 109.675 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 72.5 mt -136.35 -32.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.701 0.8 . . . . 0.0 112.616 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.51 -41.32 0.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 122.797 0.439 . . . . 0.0 112.0 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -61.28 87.78 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.925 1.29 . . . . 0.0 111.242 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 175.38 133.12 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.238 1.815 . . . . 0.0 106.307 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.3 m -52.29 -38.22 57.75 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 119.026 0.83 . . . . 0.0 113.17 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.04 -41.23 62.12 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.472 0.709 . . . . 0.0 111.141 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.9 t -76.98 -24.84 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 122.317 0.247 . . . . 0.0 110.627 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.0 -39.95 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 171.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.2 t -62.92 -43.61 98.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.631 0.772 . . . . 0.0 111.009 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -72.53 -38.36 68.05 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.567 0.747 . . . . 0.0 111.376 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.14 -46.09 75.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.291 0.636 . . . . 0.0 109.795 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.7 t -63.37 -31.8 73.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.123 0.969 . . . . 0.0 111.258 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.66 -46.57 87.61 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HG2' HG12 ' A' ' 34' ' ' VAL . 0.1 OUTLIER -71.67 -35.88 70.45 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.461 -177.257 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.53 -42.55 78.33 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.847 0.459 . . . . 0.0 110.011 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 76' ' ' THR . 2.0 tmt_? -64.56 -48.22 75.83 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.302 1.041 . . . . 0.0 110.221 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -82.31 -67.13 0.81 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.312 -175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -77.77 -47.73 18.28 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.84 -164.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.45 ' CE1' HG23 ' A' ' 34' ' ' VAL . 80.2 m-85 -79.53 -24.43 42.2 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.047 0.539 . . . . 0.0 110.982 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.0 -5.22 83.64 Favored Glycine 0 C--N 1.349 1.287 0 O-C-N 123.279 0.362 . . . . 0.0 113.369 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.441 HG13 HG21 ' A' ' 78' ' ' VAL . 40.7 t -81.9 87.92 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.271 1.029 . . . . 0.0 108.681 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 45.8 p -71.16 134.63 47.1 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.963 -168.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.62 -110.24 3.02 Favored Glycine 0 C--N 1.348 1.227 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.291 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.445 HG12 HD23 ' A' ' 94' ' ' LEU . 10.2 t 69.46 8.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 125.571 1.549 . . . . 0.0 110.823 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -48.61 -41.78 32.01 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.387 1.475 . . . . 0.0 113.146 -168.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.52 -46.91 71.48 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.365 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -73.91 -25.0 59.77 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.69 0.396 . . . . 0.0 110.838 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.15 -32.62 70.67 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.978 0.911 . . . . 0.0 110.418 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -68.21 -36.29 79.32 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.072 171.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.91 -1.75 36.66 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.542 0.737 . . . . 0.0 112.589 177.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.468 HD11 HD11 ' A' ' 94' ' ' LEU . 65.7 mt -80.76 151.81 28.62 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.284 0.493 . . . . 0.0 111.599 176.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -132.45 -44.81 0.91 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 109.361 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.543 HG22 ' HD3' ' A' ' 51' ' ' ARG . 64.1 p -117.4 156.4 27.98 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.443 0.697 . . . . 0.0 110.852 -177.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 90.6 t -67.9 -33.16 59.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.15 174.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.22 -38.96 81.24 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.089 0.956 . . . . 0.0 110.589 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.07 -31.88 66.52 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.147 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.433 HD21 HD21 ' A' ' 31' ' ' LEU . 44.1 tp -67.39 -33.9 76.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.124 0.57 . . . . 0.0 110.874 173.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -68.32 -38.96 82.08 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.93 0.492 . . . . 0.0 110.945 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -69.01 -29.18 67.31 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 175.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.468 HD11 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -65.24 -59.52 3.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.648 0.779 . . . . 0.0 109.31 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 86.0 t -58.67 -30.88 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.004 0.922 . . . . 0.0 111.076 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.98 -52.84 63.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.12 0.968 . . . . 0.0 111.097 175.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.476 ' HB3' ' HZ3' ' A' ' 97' ' ' LYS . 9.7 mtpm? -68.9 -30.05 68.45 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.533 0.733 . . . . 0.0 111.331 -177.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -83.14 -17.46 42.92 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.699 0.8 . . . . 0.0 111.612 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -83.22 -33.76 26.04 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.77 -35.59 72.68 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.718 0.807 . . . . 0.0 110.631 177.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.563 0 C-N-CA 124.4 1.08 . . . . 0.0 108.126 175.597 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 19.7 ttt . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -61.67 -57.73 10.82 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.222 1.009 . . . . 0.0 112.784 -167.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.65 -43.09 99.51 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.558 0.536 . . . . 0.0 110.679 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -67.2 -32.0 72.77 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.048 0.842 . . . . 0.0 111.308 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 24.1 tp -64.83 -45.06 87.72 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.36 -31.24 72.26 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.202 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.3 m -67.66 -42.13 82.67 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.829 0.452 . . . . 0.0 109.939 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.494 HG11 ' HG3' ' A' ' 68' ' ' LYS . 22.3 t -60.84 -44.57 97.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.352 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 53.6 mt -67.94 -32.18 72.45 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.693 0.62 . . . . 0.0 110.908 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.3 t -64.84 -35.94 82.73 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.857 0.723 . . . . 0.0 111.072 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.2 t -82.92 -25.55 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.898 0.879 . . . . 0.0 110.68 178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -82.91 -27.56 30.55 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.463 0.705 . . . . 0.0 111.904 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.1 p -107.07 -55.28 2.35 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.056 0.542 . . . . 0.0 110.544 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 130.86 -29.84 3.48 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.47 -178.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 m -79.03 140.9 57.91 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.685 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.505 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 37.7 Cg_endo -63.86 170.53 8.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.108 2.539 . . . . 0.0 113.323 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.21 -22.11 66.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.074 0.95 . . . . 0.0 111.705 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.68 -29.38 66.8 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.105 0.562 . . . . 0.0 110.835 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.505 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 11.4 mm-40 -92.5 6.33 47.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.346 0.658 . . . . 0.0 110.755 176.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -127.22 99.23 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.1 0.96 . . . . 0.0 108.821 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.483 ' OG ' ' HB2' ' A' ' 50' ' ' SER . 57.8 p -98.68 150.64 21.57 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -66.68 -24.29 66.25 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.9 0.88 . . . . 0.0 112.2 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -99.68 1.2 43.25 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.912 0.885 . . . . 0.0 111.18 -175.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.483 ' HB2' ' OG ' ' A' ' 47' ' ' SER . 9.0 t -83.35 170.21 14.81 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 123.438 0.695 . . . . 0.0 111.921 -176.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -67.68 147.65 52.38 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.149 165.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.62 ' HG3' ' HB2' ' A' ' 55' ' ' LEU . 19.8 ttt -102.29 -77.73 0.55 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.296 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 38.07 -80.07 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 113.896 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.12 -30.02 64.03 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.052 0.541 . . . . 0.0 112.218 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.62 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 51.1 mt -70.75 -25.5 62.94 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.448 0.699 . . . . 0.0 112.345 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -170.35 96.6 0.25 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.067 0.947 . . . . 0.0 110.766 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -168.07 49.19 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 177.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -161.94 134.81 6.02 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.986 -171.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.6 p -47.71 -46.7 29.87 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.647 1.179 . . . . 0.0 113.377 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.34 -39.81 74.47 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.588 0.355 . . . . 0.0 110.789 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.31 -34.86 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 123.254 0.347 . . . . 0.0 110.666 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.516 HG11 ' HB2' ' A' ' 82' ' ' LEU . 75.0 t -69.51 -39.06 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.914 0.885 . . . . 0.0 110.203 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.3 m -64.47 -44.58 90.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.402 0.681 . . . . 0.0 110.09 175.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -64.89 -44.84 88.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.28 1.032 . . . . 0.0 110.819 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.0 tp -69.21 -38.7 78.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.036 0.934 . . . . 0.0 110.407 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.0 t -61.13 -38.66 87.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.471 0.709 . . . . 0.0 110.68 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.478 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 94.0 mt -63.55 -48.75 76.21 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.875 0.735 . . . . 0.0 110.625 175.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.494 ' HG3' HG11 ' A' ' 34' ' ' VAL . 75.3 mmtt -59.72 -47.77 84.34 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.093 0.557 . . . . 0.0 111.196 -178.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.58 -29.78 69.22 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.516 0.727 . . . . 0.0 111.347 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.69 -53.06 37.63 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.197 0.999 . . . . 0.0 111.115 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 4.0 mptp? -72.4 -41.54 66.16 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.557 -177.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -82.2 -53.99 5.62 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.303 0.641 . . . . 0.0 112.175 -170.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -107.14 -14.77 14.83 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.157 0.583 . . . . 0.0 112.063 -171.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.28 -6.14 77.46 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 122.908 0.29 . . . . 0.0 112.885 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.566 HG12 HG21 ' A' ' 78' ' ' VAL . 46.0 t -80.93 80.12 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.082 0.953 . . . . 0.0 109.821 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 t -91.32 160.75 15.34 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.28 0.632 . . . . 0.0 111.251 -174.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.49 -110.97 3.15 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.566 HG21 HG12 ' A' ' 75' ' ' VAL . 3.4 t 58.15 26.19 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 125.231 1.412 . . . . 0.0 111.1 173.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -51.37 -57.67 8.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.25 1.42 . . . . 0.0 112.987 -166.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -60.0 -43.49 95.17 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.071 0.857 . . . . 0.0 110.88 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.55 ' HB2' HG13 ' A' ' 78' ' ' VAL . 38.4 mt-10 -69.77 -40.95 75.77 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.036 0.535 . . . . 0.0 111.105 -173.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.516 ' HB2' HG11 ' A' ' 62' ' ' VAL . 76.6 mt -69.95 -25.16 63.51 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.948 0.499 . . . . 0.0 111.177 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.79 -16.51 31.93 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.181 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.31 10.31 41.67 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.802 0.841 . . . . 0.0 110.052 -177.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.44 HD12 ' SD ' ' A' ' 52' ' ' MET . 24.7 mt -69.29 115.46 8.58 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -173.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -91.23 -53.41 4.37 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.07 -178.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.5 p -127.04 158.41 37.03 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.795 0.838 . . . . 0.0 110.714 -177.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -66.06 -38.55 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -56.46 -34.23 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.328 1.051 . . . . 0.0 111.533 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.2 -40.62 86.49 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.264 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.572 HD21 ' HE3' ' A' ' 52' ' ' MET . 63.4 tp -64.1 -34.46 78.08 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 123.673 0.608 . . . . 0.0 111.472 176.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -59.99 -52.53 65.01 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.798 0.439 . . . . 0.0 110.733 174.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -71.72 -19.29 62.07 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.792 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.537 HD22 HG11 ' A' ' 78' ' ' VAL . 8.2 tt -71.74 -57.69 4.14 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.706 0.802 . . . . 0.0 109.106 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.91 -31.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.325 0.65 . . . . 0.0 110.101 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -70.61 -37.71 73.87 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.631 0.773 . . . . 0.0 109.684 174.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.992 0.517 . . . . 0.0 109.822 177.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -72.9 -32.42 65.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.748 0.819 . . . . 0.0 111.25 176.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -66.09 -44.89 83.08 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.614 0.766 . . . . 0.0 110.096 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.58 64.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.286 1.034 . . . . 0.0 110.535 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.74 0 C-N-CA 123.481 0.712 . . . . 0.0 111.144 175.251 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.652 0.263 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.417 ' HG2' ' CE1' ' A' ' 92' ' ' PHE . 9.2 tm-20 -62.37 -39.92 94.76 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.879 0.872 . . . . 0.0 109.857 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -59.16 -50.78 72.73 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.225 0.61 . . . . 0.0 111.119 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.404 ' O ' HG22 ' A' ' 34' ' ' VAL . 34.8 m-70 -64.74 -36.47 84.4 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.267 0.627 . . . . 0.0 110.886 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.48 -37.41 74.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.76 -28.66 63.79 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.997 0.919 . . . . 0.0 110.187 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.6 m -71.98 -42.65 66.26 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.278 1.031 . . . . 0.0 109.952 174.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 30' ' ' HIS . 37.1 t -55.3 -46.14 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 123.567 0.747 . . . . 0.0 109.966 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.7 mt -62.14 -43.49 98.71 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.042 176.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.4 t -65.07 -34.83 79.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.033 0.933 . . . . 0.0 111.892 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.02 -37.45 17.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.481 0.712 . . . . 0.0 109.984 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.85 -26.83 59.97 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.649 0.78 . . . . 0.0 111.861 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.8 p -96.46 -41.57 8.52 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.625 0.77 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.65 -15.11 62.42 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.374 -173.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.0 m -86.76 147.05 42.56 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 123.16 0.584 . . . . 0.0 110.342 -179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -52.78 155.52 10.59 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.128 2.552 . . . . 0.0 113.956 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -63.57 -26.17 68.57 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.292 0.637 . . . . 0.0 111.139 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.01 -31.14 71.49 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.794 0.838 . . . . 0.0 111.413 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.57 -30.44 64.4 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.511 0.724 . . . . 0.0 110.537 176.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -89.67 97.12 6.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.889 -174.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -79.58 156.92 27.48 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 167.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.49 -30.28 69.07 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.22 87.04 6.35 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.2 t -142.83 142.57 31.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.708 0.803 . . . . 0.0 108.898 172.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -85.86 18.24 3.05 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.011 0.924 . . . . 0.0 112.013 -176.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.548 ' HE3' HD11 ' A' ' 85' ' ' LEU . 49.1 mtt 60.72 24.45 14.29 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 124.287 1.035 . . . . 0.0 112.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -32.92 -58.61 0.36 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 126.286 1.834 . . . . 0.0 113.497 -169.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.72 9.75 4.64 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.389 -0.823 . . . . 0.0 108.901 172.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.03 -42.4 17.53 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.701 0.8 . . . . 0.0 112.028 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.411 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -150.5 -1.94 0.38 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -86.31 76.56 9.66 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -179.8 136.3 0.12 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.275 1.43 . . . . 0.0 108.32 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.2 p -58.23 -36.84 73.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.134 0.974 . . . . 0.0 113.144 -173.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.39 -38.37 74.68 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.9 t -71.58 -31.13 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.413 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 66.7 t -69.33 -34.58 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.693 0.797 . . . . 0.0 110.168 174.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.6 t -73.76 -33.72 64.4 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.192 0.597 . . . . 0.0 110.585 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.7 -39.91 84.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.354 0.661 . . . . 0.0 109.538 173.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.444 HD13 HD23 ' A' ' 91' ' ' LEU . 59.3 tp -63.22 -51.87 64.5 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.62 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 62.0 p -62.63 -36.32 82.43 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.874 0.87 . . . . 0.0 111.376 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.9 tp -64.95 -41.72 95.25 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.741 0.65 . . . . 0.0 110.854 175.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -69.09 -35.94 77.04 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.289 0.635 . . . . 0.0 111.271 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 88.2 mt -67.75 -32.9 73.82 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.911 0.485 . . . . 0.0 110.038 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -30.88 71.9 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.768 1.227 . . . . 0.0 111.289 175.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -93.59 -61.77 1.49 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.089 0.555 . . . . 0.0 111.335 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -61.6 -47.76 84.0 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.701 1.2 . . . . 0.0 112.063 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -108.64 -18.88 13.61 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 -172.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.2 -13.41 54.92 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-O 120.095 -0.281 . . . . 0.0 113.25 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.61 100.57 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.764 0.826 . . . . 0.0 109.206 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 39.7 m -90.78 141.38 28.87 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.836 0.854 . . . . 0.0 111.794 -169.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.39 -107.72 2.68 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.819 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.522 HG12 ' HB2' ' A' ' 81' ' ' GLU . 3.7 t 64.55 15.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.94 1.296 . . . . 0.0 110.883 177.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.64 -28.39 67.19 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.578 1.151 . . . . 0.0 113.457 -166.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -63.27 -51.36 66.47 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 123.68 0.613 . . . . 0.0 110.281 175.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HB2' HG12 ' A' ' 78' ' ' VAL . 4.4 mp0 -68.9 -31.94 71.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.154 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.1 mt -73.17 -18.03 61.31 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -78.34 -35.86 47.02 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.434 0.694 . . . . 0.0 109.596 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.79 2.1 10.95 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.561 0.744 . . . . 0.0 112.499 176.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.616 HD13 HD11 ' A' ' 91' ' ' LEU . 38.8 mt -70.05 140.72 52.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.024 0.529 . . . . 0.0 112.007 172.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.41 -51.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.416 0 O-C-N 124.509 1.131 . . . . 0.0 108.206 170.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.7 p -102.87 149.07 24.87 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.129 0.572 . . . . 0.0 110.679 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.481 ' HA ' ' HE1' ' A' ' 52' ' ' MET . 4.0 m -67.38 -26.73 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.615 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.52 -45.55 77.11 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.817 . . . . 0.0 110.528 169.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.86 -40.8 85.4 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-N 114.854 -1.067 . . . . 0.0 109.877 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.616 HD11 HD13 ' A' ' 85' ' ' LEU . 47.0 tp -65.87 -39.26 90.53 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.659 0.783 . . . . 0.0 112.425 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.417 ' CE1' ' HG2' ' A' ' 28' ' ' GLU . 60.4 m-85 -62.06 -36.99 83.32 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.569 ' HA ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -82.95 -23.13 33.57 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.706 0.802 . . . . 0.0 112.271 178.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 tt -74.45 -55.37 6.04 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.55 -37.28 74.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.032 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.52 -45.75 84.63 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 123.948 0.78 . . . . 0.0 111.233 173.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -57.85 -48.47 79.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.922 0.889 . . . . 0.0 111.072 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -82.25 -33.83 29.07 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.621 -174.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.08 -42.07 48.49 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.57 -54.07 49.91 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.166 0.587 . . . . 0.0 110.28 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 C-N-CA 124.773 1.229 . . . . 0.0 113.304 173.923 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 ttp . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 119.931 -0.081 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.99 -61.93 1.68 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.899 0.88 . . . . 0.0 112.069 -171.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -65.2 -30.92 71.86 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.704 0.802 . . . . 0.0 110.478 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -63.17 -41.1 99.17 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.741 0.817 . . . . 0.0 109.584 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.517 HD23 ' HG ' ' A' ' 91' ' ' LEU . 39.2 tp -66.69 -38.92 87.75 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.184 0.994 . . . . 0.0 110.003 177.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.5 tp -62.23 -38.74 90.38 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.489 1.116 . . . . 0.0 110.777 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.3 m -66.56 -42.37 87.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.114 0.966 . . . . 0.0 110.684 176.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -57.87 -45.88 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.697 0.799 . . . . 0.0 110.861 177.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 83.5 mt -63.04 -37.94 89.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.519 0.728 . . . . 0.0 111.133 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -61.89 -37.98 86.63 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.509 0.724 . . . . 0.0 111.242 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 56.7 t -79.72 -32.91 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.506 0.723 . . . . 0.0 110.539 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.19 -14.07 58.74 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.757 0.823 . . . . 0.0 111.914 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.462 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 18.4 m -112.24 -38.86 4.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.256 0.622 . . . . 0.0 110.847 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.7 -30.28 10.58 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.008 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.62 137.84 88.33 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.289 0.635 . . . . 0.0 110.364 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.71 161.44 10.06 Favored 'Trans proline' 0 C--N 1.379 2.138 0 C-N-CA 123.46 2.773 . . . . 0.0 113.802 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.92 -29.42 70.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.713 0.805 . . . . 0.0 111.214 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.53 -18.22 64.32 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 111.609 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -89.49 -20.08 24.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.415 0.686 . . . . 0.0 111.175 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.434 HG23 HD13 ' A' ' 55' ' ' LEU . 34.4 mt -102.43 105.04 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.975 0.51 . . . . 0.0 110.892 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.9 p -95.27 -178.02 4.31 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 165.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.721 ' HA ' ' HB ' ' A' ' 88' ' ' VAL . 11.0 ptp180 -84.73 -11.53 55.64 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.596 -0.69 . . . . 0.0 111.25 175.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.99 13.45 28.91 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.607 0.763 . . . . 0.0 110.456 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -85.02 18.34 2.54 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.259 0.624 . . . . 0.0 112.577 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 68.12 167.01 0.25 Allowed 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.145 175.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.493 ' HG3' ' HB3' ' A' ' 85' ' ' LEU . 87.9 mmm -121.53 94.47 4.33 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 170.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -137.92 -65.66 0.51 Allowed 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -83.43 -35.14 25.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.245 176.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.462 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 70.1 mt -69.69 -44.11 71.1 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.257 -172.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.92 94.95 0.08 Allowed 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.512 1.133 . . . . 0.0 109.68 169.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -163.64 -37.66 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.088 0.955 . . . . 0.0 108.496 175.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -53.98 139.53 34.05 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.046 0.841 . . . . 0.0 110.041 168.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -47.73 -47.29 30.24 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.103 1.361 . . . . 0.0 113.183 -173.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.3 mt -80.36 -25.83 38.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.872 -174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.1 t -77.29 -29.24 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 123.174 0.296 . . . . 0.0 110.207 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.4 t -70.14 -44.68 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.619 0.768 . . . . 0.0 109.897 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.8 p -67.76 -33.58 75.13 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.548 0.53 . . . . 0.0 110.777 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.63 -47.65 74.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.758 0.823 . . . . 0.0 110.422 175.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.8 tp -68.89 -40.48 79.18 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 -174.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 66.5 m -62.6 -48.38 79.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.978 0.511 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.3 tp -57.05 -36.23 70.26 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.865 0.728 . . . . 0.0 110.483 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 68' ' ' LYS . 6.0 tppt? -68.61 -52.93 26.11 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.368 178.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.482 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 83.6 mt -52.01 -44.11 63.99 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.11 0.964 . . . . 0.0 111.532 -175.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -61.06 -36.93 80.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.472 1.109 . . . . 0.0 111.92 -174.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -97.92 -64.87 1.0 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.964 0.506 . . . . 0.0 110.905 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.86 -40.62 63.58 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.704 1.602 . . . . 0.0 113.24 -173.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -120.57 -14.79 8.59 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -171.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.85 16.42 79.34 Favored Glycine 0 CA--C 1.534 1.249 0 N-CA-C 113.862 0.305 . . . . 0.0 113.862 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.604 HG21 HG11 ' A' ' 95' ' ' VAL . 59.1 t -93.87 136.16 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 123.86 0.864 . . . . 0.0 108.854 176.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -67.37 156.99 35.13 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 122.736 0.415 . . . . 0.0 111.4 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.16 88.28 0.15 Allowed Glycine 0 C--N 1.357 1.699 0 O-C-N 123.41 0.444 . . . . 0.0 112.994 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.6 m -94.14 47.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.312 1.045 . . . . 0.0 111.226 -174.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -48.12 -39.85 21.76 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.409 1.484 . . . . 0.0 113.963 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.99 -52.45 65.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.335 1.054 . . . . 0.0 110.085 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.11 -25.71 61.85 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -176.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.23 -31.09 70.34 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.856 0.463 . . . . 0.0 110.85 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.53 -26.45 45.75 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.776 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -90.21 12.97 16.42 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.908 0.483 . . . . 0.0 112.22 176.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.495 HD22 HD23 ' A' ' 94' ' ' LEU . 94.1 mt -80.09 148.42 31.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.665 0.386 . . . . 0.0 110.63 172.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -115.47 -55.88 2.4 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.587 0.755 . . . . 0.0 109.858 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.3 p -119.44 163.61 16.99 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.896 0.879 . . . . 0.0 109.637 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.721 ' HB ' ' HA ' ' A' ' 48' ' ' ARG . 11.0 t -69.63 -23.25 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 30.6 t70 -57.12 -48.45 78.62 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.372 0.669 . . . . 0.0 109.739 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -55.75 -39.21 70.85 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.085 0.866 . . . . 0.0 111.265 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.517 ' HG ' HD23 ' A' ' 31' ' ' LEU . 44.4 tp -63.42 -48.45 77.74 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 123.707 0.63 . . . . 0.0 111.601 176.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -60.46 -34.75 74.46 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.363 0.665 . . . . 0.0 110.932 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 16.7 mm100 -75.91 -36.68 59.34 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.608 0.567 . . . . 0.0 110.501 177.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.495 HD23 HD22 ' A' ' 85' ' ' LEU . 26.7 tp -61.2 -53.47 56.46 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.448 0.699 . . . . 0.0 109.748 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.604 HG11 HG21 ' A' ' 75' ' ' VAL . 84.7 t -61.8 -34.73 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.659 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.43 -62.53 1.78 Allowed 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.607 0.763 . . . . 0.0 111.476 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -38.66 90.42 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.881 0.473 . . . . 0.0 111.66 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -74.44 -25.27 59.32 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.308 0.643 . . . . 0.0 112.713 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -88.28 -35.25 17.35 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.549 0.34 . . . . 0.0 110.319 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.93 -31.17 66.08 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.447 0.699 . . . . 0.0 110.77 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.166 0 C-N-CA 124.885 1.274 . . . . 0.0 111.7 -179.108 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.535 ' SD ' HD11 ' A' ' 31' ' ' LEU . 19.4 tmm? . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -59.1 -49.83 76.39 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.066 0.546 . . . . 0.0 110.831 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -49.72 -40.53 40.95 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.345 1.058 . . . . 0.0 111.536 171.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.12 -38.47 69.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.613 0.765 . . . . 0.0 111.287 -173.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.535 HD11 ' SD ' ' A' ' 27' ' ' MET . 11.1 mp -69.75 -33.29 72.23 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 117.973 0.351 . . . . 0.0 110.758 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.34 -33.9 77.06 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.428 0.455 . . . . 0.0 110.41 172.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.9 m -71.88 -39.82 69.36 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.214 0.605 . . . . 0.0 110.337 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.0 t -58.51 -49.63 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.797 0.839 . . . . 0.0 110.042 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.25 -28.3 66.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.628 0.771 . . . . 0.0 111.556 177.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 29.9 t -66.1 -38.17 87.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.842 0.457 . . . . 0.0 111.015 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.2 t -87.17 -30.12 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.09 47.82 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.233 0.613 . . . . 0.0 112.032 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.2 m -108.62 -26.0 10.6 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.184 0.594 . . . . 0.0 111.495 -175.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.49 -27.48 19.35 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-O 119.997 -0.335 . . . . 0.0 112.83 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 36' ' ' SER . 36.0 m -73.0 141.11 81.21 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 123.16 0.584 . . . . 0.0 110.214 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.42 165.63 29.92 Favored 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 122.354 2.036 . . . . 0.0 112.163 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -60.86 -23.31 65.05 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.907 0.883 . . . . 0.0 111.999 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.41 -29.18 65.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.197 0.999 . . . . 0.0 110.887 -176.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -79.66 -11.08 59.87 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.732 0.813 . . . . 0.0 111.343 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.0 mt -110.24 146.78 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.852 0.861 . . . . 0.0 109.743 -174.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.8 p -145.27 157.21 44.11 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 171.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -66.08 -22.51 66.41 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 117.759 0.254 . . . . 0.0 111.145 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -112.07 92.63 4.1 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 171.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -159.34 160.99 35.69 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.317 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmm180 -84.66 129.65 34.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.875 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.537 ' HE1' ' HA ' ' A' ' 88' ' ' VAL . 28.0 mtt -88.58 56.12 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.069 0.948 . . . . 0.0 110.116 174.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.415 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 21.4 mm-40 -71.13 -16.85 62.58 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.827 175.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.92 -30.27 0.53 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.267 1.027 . . . . 0.0 110.737 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -73.79 -10.05 59.27 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.95 33.03 0.15 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.793 0.837 . . . . 0.0 109.311 172.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -99.15 -62.1 1.28 Allowed 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.053 -171.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.48 ' HB3' HG23 ' A' ' 61' ' ' VAL . 34.5 t70 -66.8 152.62 45.19 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.991 0.516 . . . . 0.0 111.704 -176.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 m -52.8 -42.71 65.34 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.107 1.363 . . . . 0.0 112.656 -178.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -67.03 -42.23 85.23 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.834 0.709 . . . . 0.0 110.493 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.48 HG23 ' HB3' ' A' ' 58' ' ' ASP . 21.7 t -64.46 -41.86 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 O-C-N 123.693 0.621 . . . . 0.0 110.482 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.8 t -66.53 -38.95 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.977 0.911 . . . . 0.0 110.503 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.6 t -66.81 -42.38 86.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.726 0.81 . . . . 0.0 110.938 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 41.0 mt-10 -74.48 -33.06 62.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.836 0.854 . . . . 0.0 110.588 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.7 tp -65.19 -41.16 94.82 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.018 0.927 . . . . 0.0 109.734 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.8 t -62.73 -46.42 88.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.118 0.967 . . . . 0.0 110.88 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.79 -30.69 70.95 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.068 -176.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 44.8 mmtm -71.11 -59.71 2.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.783 0.433 . . . . 0.0 110.776 175.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 91' ' ' LEU . 95.9 mt -60.71 -27.6 68.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.526 0.73 . . . . 0.0 112.242 -174.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.14 -56.13 18.74 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.657 1.183 . . . . 0.0 109.683 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -81.47 -40.56 23.09 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.098 -176.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.29 -45.87 53.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.938 0.895 . . . . 0.0 112.152 -166.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.26 -8.74 7.01 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.025 -176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.53 3.64 90.1 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 120.167 -0.24 . . . . 0.0 113.022 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.51 HG11 HG23 ' A' ' 78' ' ' VAL . 59.2 t -81.89 83.8 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.928 0.891 . . . . 0.0 109.239 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -130.53 159.41 37.19 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.766 1.226 . . . . 0.0 109.009 178.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.51 24.73 62.33 Favored Glycine 0 C--N 1.337 0.638 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -167.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.51 HG23 HG11 ' A' ' 75' ' ' VAL . 28.0 m -122.4 17.47 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.299 1.44 . . . . 0.0 109.903 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.55 ' HA ' HD12 ' A' ' 82' ' ' LEU . 25.6 t70 -63.96 -31.76 73.06 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.704 0.802 . . . . 0.0 112.063 -170.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -60.91 -48.78 80.24 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.023 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -63.57 -37.18 86.34 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.495 0.718 . . . . 0.0 111.429 178.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 79' ' ' ASP . 92.1 mt -62.4 -38.11 88.4 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.002 0.921 . . . . 0.0 111.392 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.28 -24.5 59.27 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.451 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.23 -2.79 58.63 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.699 0.799 . . . . 0.0 111.945 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.9 mt -77.74 115.33 17.41 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.041 0.448 . . . . 0.0 110.403 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -116.45 -1.71 12.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.369 1.068 . . . . 0.0 109.945 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 p -143.24 137.81 29.18 Favored 'General case' 0 C--O 1.257 1.484 0 C-N-CA 124.732 1.213 . . . . 0.0 109.608 -176.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.537 ' HA ' ' HE1' ' A' ' 52' ' ' MET . 53.4 t -64.86 -35.38 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 -176.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.477 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 34.0 t70 -61.93 -35.25 77.86 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.78 0.432 . . . . 0.0 111.001 179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -68.48 -28.11 66.74 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.811 0.444 . . . . 0.0 111.713 176.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.482 HD13 HD11 ' A' ' 69' ' ' LEU . 65.7 tp -61.99 -41.0 97.54 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 123.196 0.31 . . . . 0.0 110.616 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.405 ' HD1' ' O ' ' A' ' 88' ' ' VAL . 25.7 m-85 -66.29 -39.47 89.38 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.42 0.688 . . . . 0.0 111.751 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 61.7 mm-40 -69.55 -35.43 75.4 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.436 HD11 ' HB ' ' A' ' 78' ' ' VAL . 43.2 tp -58.33 -55.43 35.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.011 0.924 . . . . 0.0 110.456 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.38 -46.46 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.785 -177.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.17 -54.63 43.61 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.658 0.783 . . . . 0.0 112.032 -176.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.23 -43.16 82.67 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.393 0.677 . . . . 0.0 111.506 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -75.83 -18.23 59.54 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.349 0.406 . . . . 0.0 112.057 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -86.34 -28.56 23.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.53 -43.7 63.17 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.352 0.661 . . . . 0.0 110.565 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 124.769 1.228 . . . . 0.0 111.47 178.513 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.3 ptm . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 119.985 -0.055 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.83 -50.33 67.08 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 124.259 1.023 . . . . 0.0 110.826 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -69.17 -31.99 71.01 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 123.683 0.614 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -65.73 -42.52 90.91 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.692 176.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.4 tt -70.68 -32.68 70.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.86 1.264 . . . . 0.0 109.173 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.7 tp -67.75 -36.72 81.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.162 0.985 . . . . 0.0 109.909 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.1 m -69.99 -36.29 75.05 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.15 0.98 . . . . 0.0 110.766 176.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.53 -46.78 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.384 0.674 . . . . 0.0 110.059 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.403 HD21 HD21 ' A' ' 91' ' ' LEU . 98.4 mt -68.33 -28.56 67.26 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.109 0.964 . . . . 0.0 111.606 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -65.4 -53.71 39.23 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.202 0.601 . . . . 0.0 110.249 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.85 -37.03 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.784 -178.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.83 -50.53 66.31 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.107 0.563 . . . . 0.0 111.33 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m -79.68 -21.0 45.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.277 0.631 . . . . 0.0 111.142 -178.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.35 4.77 83.29 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-O 119.769 -0.462 . . . . 0.0 113.6 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.8 m -105.86 149.39 37.95 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.357 1.063 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.522 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 29.7 Cg_endo -61.75 160.16 30.01 Favored 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 122.176 1.917 . . . . 0.0 112.389 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.18 -20.88 65.81 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.582 0.753 . . . . 0.0 111.649 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -68.86 -20.2 64.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.025 0.93 . . . . 0.0 112.109 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.522 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 18.0 mm-40 -82.24 -29.11 31.48 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.21 0.604 . . . . 0.0 110.527 174.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -88.71 90.83 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.54 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.3 t -79.22 -0.64 32.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.562 0.745 . . . . 0.0 111.794 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 mtm180 75.15 -35.78 0.29 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 126.465 1.906 . . . . 0.0 112.067 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -76.97 3.1 12.97 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.25 1.02 . . . . 0.0 111.327 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.7 t -54.17 132.67 43.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.399 1.079 . . . . 0.0 110.825 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -91.99 31.35 1.26 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.773 0.829 . . . . 0.0 111.446 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.728 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 17.0 mmt 62.86 15.94 8.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.147 0.979 . . . . 0.0 112.694 174.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.66 -46.16 89.86 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.475 0.71 . . . . 0.0 112.32 -168.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -124.9 5.45 8.03 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.936 0.894 . . . . 0.0 109.972 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 mp -123.65 122.02 37.05 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.277 0.631 . . . . 0.0 110.235 -169.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.608 ' HB2' ' SD ' ' A' ' 52' ' ' MET . . . 74.2 -28.93 0.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.728 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 50.4 t80 -82.56 -19.45 38.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.539 0.736 . . . . 0.0 112.731 -169.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.86 136.18 57.93 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.703 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.9 m -54.36 -39.66 67.37 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.654 0.782 . . . . 0.0 113.084 -170.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.3 -42.27 93.23 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.39 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 27.2 t -74.99 -23.28 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.402 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.2 t -71.58 -34.03 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 172.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.1 m -69.94 -31.71 69.59 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.467 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -77.33 -29.12 53.35 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.43 0.692 . . . . 0.0 111.224 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -48.05 58.45 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.411 0.685 . . . . 0.0 109.35 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 26.9 p -61.81 -39.0 90.23 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.281 176.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.2 tp -57.62 -52.15 66.58 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.685 0.794 . . . . 0.0 111.325 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -68.78 -61.7 1.7 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.495 -175.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.6 mt -51.69 -35.68 43.65 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.78 0.675 . . . . 0.0 111.89 -176.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 66' ' ' SER . 60.8 ttt180 -55.81 -44.42 77.84 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.004 1.322 . . . . 0.0 112.816 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -100.17 -54.61 2.83 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.191 0.596 . . . . 0.0 111.619 -178.056 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -51.99 -48.7 64.3 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.239 1.416 . . . . 0.0 112.413 -176.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -116.59 -12.2 10.97 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.208 0.603 . . . . 0.0 111.884 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.44 -11.22 59.27 Favored Glycine 0 N--CA 1.473 1.161 0 CA-C-O 120.046 -0.308 . . . . 0.0 113.465 -176.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.666 HG23 HG12 ' A' ' 95' ' ' VAL . 50.6 t -71.7 92.52 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 124.514 1.125 . . . . 0.0 109.989 -174.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -117.66 166.1 12.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.272 0.629 . . . . 0.0 110.936 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.22 65.79 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.575 0.547 . . . . 0.0 113.027 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.3 m -98.8 8.94 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.086 0.955 . . . . 0.0 111.75 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.407 ' HA ' HD12 ' A' ' 82' ' ' LEU . 6.8 p-10 -58.38 -33.38 69.54 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.622 1.169 . . . . 0.0 111.509 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -58.71 -57.83 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.68 1.192 . . . . 0.0 110.958 175.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.544 ' HG3' HD13 ' A' ' 94' ' ' LEU . 9.6 pt-20 -77.42 -19.66 55.76 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.03 -174.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 79' ' ' ASP . 34.8 mt -64.41 -39.64 94.25 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.046 0.938 . . . . 0.0 110.233 169.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -67.84 -35.65 78.96 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.484 173.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.51 -4.21 47.46 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.481 0.712 . . . . 0.0 112.744 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 91' ' ' LEU . 87.4 mt -74.91 140.69 43.96 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.776 0.43 . . . . 0.0 111.476 177.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.36 -0.1 5.68 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.222 1.009 . . . . 0.0 109.666 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p -155.09 140.03 17.3 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.305 1.042 . . . . 0.0 110.868 -170.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.3 t -75.77 -33.2 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.025 0.93 . . . . 0.0 111.329 -174.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.58 -38.31 87.09 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.155 0.502 . . . . 0.0 110.705 176.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.29 -29.48 68.27 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.962 0.905 . . . . 0.0 111.528 174.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.51 ' HB2' HD11 ' A' ' 85' ' ' LEU . 33.7 tp -66.72 -38.72 87.27 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.647 0.379 . . . . 0.0 111.553 171.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -61.39 -48.1 82.8 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 174.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -62.85 -30.02 71.19 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.702 0.801 . . . . 0.0 112.447 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.544 HD13 ' HG3' ' A' ' 81' ' ' GLU . 7.1 tt -61.27 -58.18 9.31 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.385 1.074 . . . . 0.0 109.206 175.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.666 HG12 HG23 ' A' ' 75' ' ' VAL . 96.4 t -63.92 -40.37 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.966 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.69 -35.78 80.94 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.711 0.804 . . . . 0.0 111.309 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -66.71 -46.6 75.01 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -72.09 -24.31 61.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.715 0.806 . . . . 0.0 111.456 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.3 -34.0 59.07 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.05 -18.91 38.03 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.543 0.737 . . . . 0.0 111.354 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.442 0 C-N-CA 125.291 1.437 . . . . 0.0 112.059 -172.523 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.973 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.42 -46.35 90.31 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 124.11 0.964 . . . . 0.0 111.423 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.13 -37.32 87.06 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.807 0.692 . . . . 0.0 110.469 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.458 ' O ' HG22 ' A' ' 34' ' ' VAL . 27.5 m170 -72.89 -30.36 63.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.455 0.702 . . . . 0.0 110.734 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.48 -34.65 65.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.151 0.98 . . . . 0.0 108.848 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.15 -31.81 70.73 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.579 175.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.5 m -70.13 -38.84 75.63 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.004 0.922 . . . . 0.0 110.243 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 30' ' ' HIS . 67.5 t -57.87 -50.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.207 0.603 . . . . 0.0 109.713 174.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 81.9 mt -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.005 0.922 . . . . 0.0 112.078 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.4 t -64.26 -48.58 75.2 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.132 0.573 . . . . 0.0 110.661 178.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -77.97 -23.18 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.862 0.865 . . . . 0.0 110.841 -177.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.483 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -79.38 -42.89 24.55 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.435 0.694 . . . . 0.0 111.014 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.3 p -80.52 -53.58 6.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.391 0.676 . . . . 0.0 110.593 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.3 -23.57 6.79 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.853 -174.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.2 m -87.14 149.83 48.26 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 123.582 0.753 . . . . 0.0 109.764 176.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.463 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 69.6 Cg_endo -71.22 165.88 31.01 Favored 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 122.394 2.063 . . . . 0.0 112.164 179.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.15 -26.97 66.7 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.714 0.806 . . . . 0.0 111.406 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.04 -33.33 75.21 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.643 0.777 . . . . 0.0 111.739 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.463 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 13.2 mm-40 -84.91 -18.86 33.36 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.241 0.616 . . . . 0.0 111.734 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.9 mt -97.6 154.19 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.78 0.832 . . . . 0.0 109.66 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 t -155.68 177.13 11.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -59.07 -40.99 86.91 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -79.99 81.34 6.27 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.458 -1.246 . . . . 0.0 108.497 176.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.1 t -162.1 113.95 1.68 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-N 114.278 -1.328 . . . . 0.0 108.388 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -68.37 108.66 3.32 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.546 ' SD ' ' HB1' ' A' ' 56' ' ' ALA . 50.6 ttm -73.47 76.55 1.43 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.206 1.402 . . . . 0.0 110.461 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -123.72 16.32 9.48 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.974 0.909 . . . . 0.0 109.852 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -157.55 -44.68 0.07 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.456 1.102 . . . . 0.0 109.663 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.51 -30.26 68.08 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.927 -170.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.546 ' HB1' ' SD ' ' A' ' 52' ' ' MET . . . -154.84 39.37 0.43 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.238 0.615 . . . . 0.0 110.374 179.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -106.83 -30.96 8.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.855 -176.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.53 140.84 58.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.398 0.679 . . . . 0.0 110.738 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -54.14 -43.54 70.63 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.179 0.992 . . . . 0.0 113.464 -173.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 tt -68.36 -39.0 81.95 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.483 HG13 ' HB1' ' A' ' 38' ' ' ALA . 36.4 t -69.34 -32.9 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 122.984 0.514 . . . . 0.0 111.243 -179.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.9 -40.47 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.246 0.618 . . . . 0.0 109.816 175.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.401 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 33.7 m -64.89 -47.64 77.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.031 176.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.21 -41.18 83.45 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.706 1.202 . . . . 0.0 110.482 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 40.8 tp -64.66 -50.98 64.94 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.29 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -55.48 -47.58 75.91 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.012 0.925 . . . . 0.0 111.966 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 63' ' ' SER . 87.9 mt -66.39 -35.53 80.57 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.457 0.703 . . . . 0.0 111.27 -178.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -73.42 -40.98 63.83 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 123.64 0.587 . . . . 0.0 110.468 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.0 mt -65.9 -36.34 83.12 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.579 0.752 . . . . 0.0 110.2 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 ttp85 -62.46 -51.0 69.23 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.553 1.141 . . . . 0.0 110.966 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -49.37 51.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.466 -174.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -88.15 -53.54 4.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.567 0.747 . . . . 0.0 111.53 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.451 ' HD2' ' HA ' ' A' ' 69' ' ' LEU . 92.8 m-85 -94.59 -13.54 25.86 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.31 0.644 . . . . 0.0 112.155 -171.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.1 5.05 90.02 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 116.915 -0.129 . . . . 0.0 113.106 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.436 HG22 HG12 ' A' ' 95' ' ' VAL . 75.9 t -81.95 111.29 18.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.036 0.934 . . . . 0.0 109.512 -179.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.7 p -62.52 171.55 1.93 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.089 0.955 . . . . 0.0 112.293 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.7 92.49 0.01 OUTLIER Glycine 0 C--N 1.358 1.755 0 O-C-N 124.147 0.904 . . . . 0.0 113.353 -177.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 8.9 m -104.39 37.61 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.371 1.068 . . . . 0.0 110.663 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.55 -41.31 66.33 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.429 1.092 . . . . 0.0 112.29 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -62.93 -44.7 95.35 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.77 0.828 . . . . 0.0 110.609 176.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 25.7 mm-40 -64.92 -31.88 73.33 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.955 178.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 76.0 mt -71.73 -36.72 70.56 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.168 0.587 . . . . 0.0 111.731 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -75.83 -23.2 55.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 110.661 -0.126 . . . . 0.0 110.661 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 81' ' ' GLU . 89.6 mt -68.55 -19.55 64.5 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.3 0.64 . . . . 0.0 111.882 171.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 29.3 mt -82.6 150.66 26.74 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.956 0.503 . . . . 0.0 110.111 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -136.12 -6.1 2.09 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.044 0.938 . . . . 0.0 109.594 175.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.2 m -141.64 154.32 45.3 Favored 'General case' 0 C--O 1.246 0.897 0 C-N-CA 123.027 0.531 . . . . 0.0 110.277 -174.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.04 -32.12 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 123.727 0.811 . . . . 0.0 111.42 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.67 -49.44 67.98 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.074 0.55 . . . . 0.0 110.72 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.01 -37.74 83.6 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.295 -176.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.5 tp -67.29 -47.87 69.33 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.358 0.412 . . . . 0.0 111.848 176.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -59.59 -43.84 93.57 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.556 0.742 . . . . 0.0 111.778 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.7 -31.21 57.08 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.14 0.275 . . . . 0.0 111.479 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.15 -51.23 68.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.984 0.513 . . . . 0.0 110.403 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.436 HG12 HG22 ' A' ' 75' ' ' VAL . 81.1 t -65.47 -42.02 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.847 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -63.65 -45.78 88.6 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 123.672 0.607 . . . . 0.0 111.373 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -73.82 -28.23 61.51 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.212 0.605 . . . . 0.0 111.49 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -81.33 -19.97 41.68 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.681 0.392 . . . . 0.0 110.789 175.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -81.78 -30.63 32.24 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 174.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.5 -30.56 29.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.812 0.845 . . . . 0.0 110.668 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.781 0 C-N-CA 124.07 0.948 . . . . 0.0 108.798 178.424 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.05 80.82 1.55 Allowed Glycine 0 C--N 1.344 1.006 0 O-C-N 123.318 0.386 . . . . 0.0 112.192 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.1 p -163.51 145.88 9.8 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.166 0.986 . . . . 0.0 109.215 178.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 t -156.09 58.9 0.59 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -68.33 123.8 21.76 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.495 -174.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -146.87 115.48 6.76 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.581 1.153 . . . . 0.0 107.93 174.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -114.31 39.63 2.72 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.193 0.597 . . . . 0.0 109.641 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 t60 -59.06 126.83 29.3 Favored 'General case' 0 C--N 1.357 0.916 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.738 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -102.2 134.14 45.93 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.954 0.902 . . . . 0.0 108.832 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -65.86 -35.77 81.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 123.58 0.55 . . . . 0.0 110.693 177.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.2 m 71.31 124.82 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 125.289 1.435 . . . . 0.0 110.83 -176.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.4 p -147.95 34.85 0.83 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.417 1.087 . . . . 0.0 109.562 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.82 100.83 0.22 Allowed Glycine 0 C--N 1.357 1.697 0 CA-C-N 115.196 -0.911 . . . . 0.0 113.013 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -136.76 139.57 41.94 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 124.166 0.986 . . . . 0.0 108.393 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -161.35 99.14 1.16 Allowed 'General case' 0 C--O 1.241 0.619 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -177.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -164.89 100.91 0.77 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.5 mp -115.05 116.57 28.65 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.654 0.782 . . . . 0.0 109.778 -174.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -124.4 160.22 28.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.154 0.982 . . . . 0.0 109.785 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -105.03 20.76 18.29 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 109.982 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.87 93.22 0.96 Allowed 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.603 0.761 . . . . 0.0 110.447 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -153.67 19.3 0.68 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.951 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -110.77 126.33 54.48 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.188 0.995 . . . . 0.0 109.004 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 88.2 mtp 59.47 81.24 0.25 Allowed Pre-proline 0 CA--C 1.555 1.155 0 O-C-N 124.635 1.209 . . . . 0.0 111.546 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.12 80.22 2.51 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 122.44 2.093 . . . . 0.0 110.342 174.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.7 -45.71 77.8 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.482 1.113 . . . . 0.0 110.982 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -90.25 96.89 10.88 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.914 175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.6 ttt -55.64 -40.82 72.7 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.894 170.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.31 -41.39 88.91 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 124.51 1.131 . . . . 0.0 111.539 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.68 -45.29 93.47 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.139 0.576 . . . . 0.0 110.721 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -70.3 -33.48 71.6 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.725 0.641 . . . . 0.0 110.696 -175.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.03 -36.31 61.9 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.899 0.88 . . . . 0.0 108.716 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.62 -32.74 74.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.283 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.516 ' HA ' ' HE3' ' A' ' 43' ' ' LYS . 77.9 m -72.57 -38.25 67.97 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.866 0.866 . . . . 0.0 110.627 176.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.29 -45.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.393 0.677 . . . . 0.0 110.127 172.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 71.6 mt -68.82 -37.15 79.01 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.093 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.5 t -67.98 -29.36 68.37 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.375 0.67 . . . . 0.0 111.448 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.4 t -85.23 -43.11 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 123.439 0.696 . . . . 0.0 110.272 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.9 -43.72 87.34 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.534 0.734 . . . . 0.0 111.222 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 m -81.41 -30.44 33.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.849 0.859 . . . . 0.0 110.169 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.07 -11.29 65.48 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.397 -0.365 . . . . 0.0 113.331 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 33.4 m -91.15 145.16 31.05 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 123.842 0.857 . . . . 0.0 110.61 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -54.88 169.91 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.852 3.034 . . . . 0.0 115.432 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HE3' ' HA ' ' A' ' 33' ' ' THR . 44.5 mmtm -60.25 -34.92 74.37 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.115 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.85 -30.95 71.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.314 0.646 . . . . 0.0 111.571 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.55 -4.29 55.6 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mt -127.34 133.29 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.278 0.631 . . . . 0.0 109.507 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.6 t -135.51 167.83 20.36 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.586 0.754 . . . . 0.0 109.44 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -64.38 -55.68 19.45 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.75 89.82 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -170.31 154.26 4.76 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.197 -1.365 . . . . 0.0 108.457 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -94.25 153.34 18.09 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 123.79 0.836 . . . . 0.0 109.472 177.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.658 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 20.0 mmt -73.59 97.17 2.57 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.87 -121.61 0.26 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.374 1.069 . . . . 0.0 108.514 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -85.25 54.46 3.11 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 122.717 1.246 . . . . 0.0 109.25 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.2 mt -127.79 -46.41 1.42 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.778 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.509 ' HB1' ' SD ' ' A' ' 52' ' ' MET . . . -163.71 21.7 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.426 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.658 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 49.0 t80 -122.58 75.85 1.29 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 121.965 0.888 . . . . 0.0 110.023 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.5 t70 179.55 135.74 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 113.506 -1.679 . . . . 0.0 107.16 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.3 p -52.03 -39.21 59.18 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.893 0.877 . . . . 0.0 113.118 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -68.09 -47.86 67.09 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.764 0.426 . . . . 0.0 110.677 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.47 -28.18 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 -176.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.9 t -74.75 -38.27 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.753 0.821 . . . . 0.0 109.86 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -68.07 -35.28 77.95 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.918 0.487 . . . . 0.0 110.525 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 10.5 tp10 -70.84 -42.92 69.53 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.388 0.675 . . . . 0.0 109.922 176.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.479 HD23 ' HB3' ' A' ' 56' ' ' ALA . 56.0 tp -61.29 -48.43 81.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.305 1.042 . . . . 0.0 110.502 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 32.6 t -57.96 -47.64 82.33 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.134 0.974 . . . . 0.0 109.593 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 45.0 tp -53.29 -40.61 64.84 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.15 0.98 . . . . 0.0 111.22 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 71.9 mmtt -65.81 -55.11 18.85 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.566 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 97.7 mt -56.68 -32.14 65.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.082 0.953 . . . . 0.0 112.588 -173.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 66' ' ' SER . 45.7 mtm180 -59.75 -37.06 77.94 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.493 0.717 . . . . 0.0 111.044 178.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -93.91 -49.22 5.91 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.863 0.865 . . . . 0.0 111.239 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.59 -40.66 69.75 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.768 0.827 . . . . 0.0 111.83 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -125.5 -6.11 7.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.128 0.571 . . . . 0.0 111.909 -175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 75.78 3.6 73.96 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 113.609 0.204 . . . . 0.0 113.609 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.647 HG23 HG12 ' A' ' 95' ' ' VAL . 75.1 t -77.91 98.81 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.991 0.916 . . . . 0.0 109.679 -176.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 25.3 m -123.45 149.69 44.77 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.976 0.911 . . . . 0.0 110.168 -172.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.58 15.25 80.62 Favored Glycine 0 C--N 1.354 1.552 0 O-C-N 123.436 0.46 . . . . 0.0 113.827 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 15.9 m -92.05 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.166 0.986 . . . . 0.0 112.225 -173.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -54.42 -45.62 73.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.123 0.969 . . . . 0.0 111.938 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -65.5 -38.42 89.66 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 124.161 0.913 . . . . 0.0 110.982 -178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.464 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 5.1 mp0 -65.85 -40.38 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.248 1.019 . . . . 0.0 110.947 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.436 ' HA ' ' HG ' ' A' ' 85' ' ' LEU . 85.6 mt -76.01 -25.24 55.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 110.784 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.06 -28.34 62.26 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.061 0.944 . . . . 0.0 110.424 173.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -90.95 10.18 27.56 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.319 1.048 . . . . 0.0 112.35 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.496 HD11 ' HE2' ' A' ' 52' ' ' MET . 78.9 mt -79.53 126.99 31.58 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.89 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -126.73 -45.95 1.59 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.412 1.085 . . . . 0.0 108.083 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 35.5 p -115.61 154.86 28.68 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.816 0.817 . . . . 0.0 110.767 172.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.485 ' HA ' ' HE3' ' A' ' 52' ' ' MET . 53.0 t -70.74 -36.82 66.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.115 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.71 -37.77 82.79 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.229 0.611 . . . . 0.0 110.56 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.27 -39.06 85.5 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 124.05 0.844 . . . . 0.0 110.854 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.409 HD13 HD13 ' A' ' 85' ' ' LEU . 44.3 tp -62.71 -42.36 99.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 123.401 0.438 . . . . 0.0 111.397 174.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -59.57 -45.3 92.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.987 0.515 . . . . 0.0 110.638 175.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.15 -31.82 70.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.016 0.927 . . . . 0.0 111.445 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tt -70.22 -55.82 8.34 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.789 0.836 . . . . 0.0 109.653 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.647 HG12 HG23 ' A' ' 75' ' ' VAL . 59.6 t -64.49 -29.19 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 O-C-N 124.076 0.86 . . . . 0.0 110.15 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -61.53 -54.17 46.72 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.077 0.951 . . . . 0.0 110.175 173.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -69.41 -27.19 65.07 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.741 0.816 . . . . 0.0 111.308 -178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -79.23 -32.29 43.88 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.927 0.891 . . . . 0.0 110.22 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -74.23 -41.09 61.91 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.475 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.47 97.29 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.706 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 62.02 -170.75 0.16 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 125.367 1.467 . . . . 0.0 112.295 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -109.24 12.73 33.79 Favored Glycine 0 C--N 1.347 1.148 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.356 174.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.793 0.837 . . . . 0.0 109.449 179.909 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -86.72 9.26 72.21 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.675 0.609 . . . . 0.0 113.383 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.6 m -64.73 90.24 0.08 Allowed 'General case' 0 C--N 1.355 0.817 0 C-N-CA 124.217 1.007 . . . . 0.0 110.025 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -157.72 94.85 1.38 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.551 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -76.99 169.19 18.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.24 0.616 . . . . 0.0 109.484 173.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -76.72 154.9 33.69 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -144.21 151.84 40.04 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 108.662 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -122.73 167.86 12.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.928 0.891 . . . . 0.0 109.473 -177.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -124.72 161.4 26.45 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.975 0.91 . . . . 0.0 110.109 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -154.19 130.8 10.68 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.189 0.996 . . . . 0.0 109.207 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.0 p -111.79 144.73 40.61 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.212 1.005 . . . . 0.0 109.637 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.3 p -74.4 -22.91 58.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.864 0.865 . . . . 0.0 111.478 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.05 -145.92 43.81 Favored Glycine 0 C--N 1.353 1.512 0 O-C-N 123.731 0.645 . . . . 0.0 111.515 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -162.39 134.28 5.41 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.292 0.637 . . . . 0.0 109.796 172.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -82.94 -25.34 32.47 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.969 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -71.51 104.57 3.31 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -135.37 -178.37 5.08 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.265 1.026 . . . . 0.0 110.055 -176.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 66.75 87.65 0.12 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.994 1.318 . . . . 0.0 111.386 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -110.35 10.97 23.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.667 0.787 . . . . 0.0 110.841 173.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -70.69 110.86 5.75 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.563 0.745 . . . . 0.0 109.845 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.04 -92.05 0.37 Allowed Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -170.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.5 m80 -135.02 -89.33 0.34 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 170.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 28.0 ttt -171.72 87.12 0.45 Allowed Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -78.51 155.15 27.94 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 122.683 2.255 . . . . 0.0 112.501 -177.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 60.64 89.01 0.08 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.464 1.106 . . . . 0.0 111.642 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -86.71 78.86 9.03 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -134.05 -60.0 0.82 Allowed 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.316 0.646 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.475 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 45.3 tt0 -73.16 -64.26 1.01 Allowed 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -171.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.07 -34.02 74.24 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.81 0.844 . . . . 0.0 110.115 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -63.55 -42.8 98.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.094 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.497 HD21 ' HG ' ' A' ' 91' ' ' LEU . 33.6 tp -74.36 -33.07 62.99 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.519 0.512 . . . . 0.0 110.959 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.6 -28.78 69.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.329 0.252 . . . . 0.0 110.874 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.425 ' HA ' ' HG ' ' A' ' 36' ' ' SER . 32.3 m -72.41 -43.77 63.4 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.827 0.451 . . . . 0.0 110.297 172.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.87 -44.49 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.705 0.802 . . . . 0.0 110.567 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.12 -42.51 80.08 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.348 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.425 ' HG ' ' HA ' ' A' ' 33' ' ' THR . 77.9 p -65.79 -34.74 78.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.729 0.299 . . . . 0.0 111.53 -176.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.28 -36.79 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 C-N-CA 123.497 0.719 . . . . 0.0 110.83 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.32 -36.93 45.75 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.873 0.469 . . . . 0.0 112.038 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 m -87.23 -55.16 3.94 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.925 0.89 . . . . 0.0 110.33 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.5 -24.74 7.96 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.738 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.6 m -76.29 131.26 75.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 122.912 0.485 . . . . 0.0 110.041 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.48 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 25.5 Cg_endo -61.27 161.74 22.34 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.683 2.256 . . . . 0.0 112.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -59.39 -26.06 64.81 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 124.874 1.27 . . . . 0.0 112.467 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -68.38 -24.46 64.78 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.942 0.897 . . . . 0.0 111.369 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.48 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 12.9 mm-40 -85.92 -19.1 31.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.684 0.793 . . . . 0.0 110.92 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.3 mt -99.62 133.75 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.601 0.761 . . . . 0.0 110.33 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 t -121.86 168.55 11.73 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.861 0.864 . . . . 0.0 109.136 172.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -73.34 -20.55 60.76 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.926 0.491 . . . . 0.0 111.832 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.97 1.07 30.74 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.801 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.5 t -65.32 152.14 44.52 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.203 0.601 . . . . 0.0 111.942 -171.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -73.87 160.47 31.38 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.616 0.767 . . . . 0.0 110.606 175.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.666 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 17.4 mmt -104.9 26.67 8.92 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.063 0.945 . . . . 0.0 110.805 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.05 -61.65 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.165 0.507 . . . . 0.0 110.468 -170.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -94.07 -16.16 24.08 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.1 mp -85.61 -17.08 37.22 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.184 0.994 . . . . 0.0 112.278 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.666 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -156.42 -152.82 0.39 Allowed 'General case' 0 C--O 1.246 0.908 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 62.56 61.79 1.19 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.445 1.098 . . . . 0.0 112.125 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -177.03 137.52 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 113.197 -1.819 . . . . 0.0 106.918 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.7 m -56.47 -35.44 67.94 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.745 0.653 . . . . 0.0 111.752 -175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -81.48 -38.48 26.28 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.958 0.503 . . . . 0.0 110.822 -174.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.36 -39.71 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 121.372 0.606 . . . . 0.0 110.752 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.5 HG11 ' HB2' ' A' ' 82' ' ' LEU . 56.1 t -72.8 -31.3 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.567 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.5 t -69.03 -33.77 74.16 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.688 0.395 . . . . 0.0 110.309 173.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -70.49 -40.4 73.63 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.158 0.983 . . . . 0.0 110.035 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 38.6 tp -74.36 -35.21 63.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.946 0.899 . . . . 0.0 111.246 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.3 p -72.49 -40.78 66.63 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.845 0.458 . . . . 0.0 109.938 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.0 tp -58.3 -38.76 77.7 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 124.181 0.925 . . . . 0.0 110.466 171.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -64.03 -57.97 8.08 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.469 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.409 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 91.2 mt -62.16 -36.27 81.33 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.579 0.752 . . . . 0.0 111.471 -177.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -56.18 -42.73 77.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.827 1.251 . . . . 0.0 110.886 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -86.66 -32.65 20.42 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.261 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -90.42 -55.04 3.74 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.962 0.505 . . . . 0.0 111.786 -165.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -110.73 -1.83 16.5 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.847 0.859 . . . . 0.0 110.813 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.12 7.13 86.71 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.126 0.393 . . . . 0.0 113.245 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.409 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 42.4 t -81.92 95.02 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 123.597 0.759 . . . . 0.0 109.68 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.5 m -111.12 155.25 23.13 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.295 1.038 . . . . 0.0 111.322 -171.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.53 80.45 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 116.583 -0.28 . . . . 0.0 113.491 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 30.3 m -93.07 16.1 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.913 0.885 . . . . 0.0 111.551 -176.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -54.87 -52.48 62.69 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.139 0.975 . . . . 0.0 111.042 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -57.29 -42.91 82.6 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 24.1 mm-40 -60.55 -37.21 80.5 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.23 0.612 . . . . 0.0 111.421 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.5 ' HB2' HG11 ' A' ' 62' ' ' VAL . 87.3 mt -66.18 -35.29 80.06 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.956 0.902 . . . . 0.0 111.226 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -58.86 -43.0 90.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.698 172.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.7 -21.04 61.83 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 82.8 mt -76.76 126.78 31.56 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.53 0.332 . . . . 0.0 110.667 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -102.96 -26.75 12.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.525 0.73 . . . . 0.0 111.107 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 37.0 p -131.4 164.19 26.24 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.408 0.623 . . . . 0.0 111.263 -178.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.5 ' HA ' ' HE1' ' A' ' 52' ' ' MET . 85.7 t -69.3 -36.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.016 -176.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.13 -29.27 68.14 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.977 0.511 . . . . 0.0 111.54 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.412 ' HB3' HD22 ' A' ' 85' ' ' LEU . 47.1 mt-10 -66.5 -39.44 88.71 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.608 0.363 . . . . 0.0 110.476 171.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.497 ' HG ' HD21 ' A' ' 31' ' ' LEU . 37.5 tp -62.76 -42.78 99.84 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.983 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.1 m-85 -57.95 -58.24 9.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.436 0.694 . . . . 0.0 111.328 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -64.07 -24.88 67.87 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.443 0.464 . . . . 0.0 111.533 -176.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.6 tp -69.94 -50.04 45.92 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.293 0.371 . . . . 0.0 110.305 175.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 89.6 t -58.58 -44.99 90.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.056 0.542 . . . . 0.0 110.326 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -67.44 -46.74 72.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.83 0.852 . . . . 0.0 111.895 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -63.23 -56.13 19.11 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.495 0.718 . . . . 0.0 110.589 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -65.95 -22.27 66.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.367 1.067 . . . . 0.0 112.0 -175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -68.94 -56.95 6.26 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.266 0.626 . . . . 0.0 110.261 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -88.35 -62.41 1.5 Allowed 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.348 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.68 84.91 5.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.6 0.76 . . . . 0.0 110.027 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.45 3.34 Favored Glycine 0 CA--C 1.536 1.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.975 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 36.6 p . . . . . 0 C--O 1.253 1.237 0 C-N-CA 124.026 0.93 . . . . 0.0 109.353 -179.126 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.2 mtm . . . . . 0 N--CA 1.484 1.226 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.15 11.06 53.72 Favored Glycine 0 C--N 1.347 1.188 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.969 176.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.2 p -81.47 74.6 8.46 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.6 0.714 . . . . 0.0 110.584 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 m -87.36 118.25 26.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.336 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -136.31 93.75 2.93 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -98.06 99.01 10.25 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.741 0.816 . . . . 0.0 109.424 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -79.85 118.37 21.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.612 0.765 . . . . 0.0 109.596 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -155.06 115.21 3.8 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.143 0.577 . . . . 0.0 109.611 176.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -143.34 120.53 11.5 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.083 0.953 . . . . 0.0 108.845 175.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.1 t60 -149.57 84.23 1.42 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.076 0.95 . . . . 0.0 108.567 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 p -110.3 132.55 54.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.649 0.78 . . . . 0.0 110.065 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.6 p -161.4 -62.43 0.05 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.21 1.004 . . . . 0.0 109.151 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 82.07 137.41 2.51 Favored Glycine 0 C--N 1.347 1.16 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.749 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -83.73 -48.84 9.7 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.86 0.864 . . . . 0.0 109.872 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -90.9 82.63 5.64 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.177 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.27 149.84 25.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.746 0.819 . . . . 0.0 110.306 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.4 mt 64.26 -177.97 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.784 1.233 . . . . 0.0 112.823 173.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -147.48 107.23 3.96 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.592 0.757 . . . . 0.0 109.557 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -107.58 98.12 7.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -120.12 82.86 1.96 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.844 0.858 . . . . 0.0 109.919 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.94 -42.56 6.7 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.31 -178.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -75.63 98.49 4.05 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.447 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . 21.6 ptt? -148.48 91.27 4.75 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 123.839 0.856 . . . . 0.0 109.473 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -79.96 8.72 3.9 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 123.165 2.577 . . . . 0.0 113.991 -174.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.447 ' ND2' ' HB2' ' A' ' 23' ' ' MET . 8.9 p30 -72.06 -47.08 54.2 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.301 0.641 . . . . 0.0 111.499 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.0 t70 53.25 71.56 0.49 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.332 1.053 . . . . 0.0 109.734 -173.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -170.62 -55.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.777 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.38 -41.44 89.38 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.612 0.765 . . . . 0.0 111.349 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -74.22 -29.91 61.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.947 1.299 . . . . 0.0 110.814 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.409 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.1 t60 -70.79 -48.72 52.72 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.702 0.801 . . . . 0.0 109.792 -178.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.508 HD23 ' HG ' ' A' ' 91' ' ' LEU . 8.1 mp -62.62 -35.98 81.29 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.265 0.978 . . . . 0.0 110.384 175.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -61.19 -39.5 90.4 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.915 0.886 . . . . 0.0 110.905 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.4 m -70.23 -39.76 74.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.896 0.878 . . . . 0.0 110.977 175.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.485 HG11 ' HG2' ' A' ' 68' ' ' LYS . 64.5 t -59.77 -48.41 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.367 0.667 . . . . 0.0 110.553 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.32 -31.5 71.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.722 0.809 . . . . 0.0 111.256 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 t -61.72 -43.21 99.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.306 0.642 . . . . 0.0 111.356 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.6 t -79.07 -46.03 23.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.036 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.5 -43.27 73.46 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.852 0.861 . . . . 0.0 112.085 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 m -91.8 -15.35 28.38 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.156 0.582 . . . . 0.0 111.617 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.12 21.5 70.51 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 114.239 0.455 . . . . 0.0 114.239 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.47 152.76 42.91 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 124.245 1.018 . . . . 0.0 110.442 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.76 151.92 45.19 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.506 2.137 . . . . 0.0 112.384 165.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.75 -26.41 68.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.756 0.822 . . . . 0.0 111.32 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -75.28 -19.98 59.39 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.138 0.975 . . . . 0.0 111.573 -176.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.59 -36.59 73.64 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.551 0.691 . . . . 0.0 109.487 176.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.437 HG22 HG23 ' A' ' 88' ' ' VAL . 47.9 mt -91.18 89.65 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.827 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -94.18 26.49 3.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.715 0.806 . . . . 0.0 110.669 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.16 -48.17 0.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.136 1.774 . . . . 0.0 110.302 -168.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.28 82.35 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.595 0.758 . . . . 0.0 109.683 164.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.458 ' HB2' HG23 ' A' ' 88' ' ' VAL . 48.8 m -160.57 153.76 21.74 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.548 1.139 . . . . 0.0 109.127 -177.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -101.58 135.95 42.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.058 0.943 . . . . 0.0 109.953 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.518 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 71.9 mmm -81.54 6.41 14.96 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.963 0.505 . . . . 0.0 111.644 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.81 -30.95 71.17 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.491 0.716 . . . . 0.0 111.265 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.44 -43.67 6.81 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.401 167.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 62.2 mt -75.97 -11.5 59.97 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.488 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -169.36 13.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -108.3 -20.14 13.24 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 118.477 0.581 . . . . 0.0 112.341 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.413 ' O ' HG21 ' A' ' 62' ' ' VAL . 24.3 t70 -70.68 135.47 48.35 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 m -54.38 -35.84 63.26 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -172.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.45 -41.12 73.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.27 -35.89 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 123.866 0.729 . . . . 0.0 111.286 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.413 HG21 ' O ' ' A' ' 58' ' ' ASP . 62.4 t -64.06 -44.9 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.7 t -69.24 -37.82 78.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.922 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.93 -35.34 64.59 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.788 0.835 . . . . 0.0 110.796 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.15 -41.39 63.98 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.183 0.993 . . . . 0.0 109.527 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.3 t -60.23 -43.57 95.94 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.709 0.803 . . . . 0.0 109.835 173.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.72 -40.47 95.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.801 1.24 . . . . 0.0 110.639 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HG2' HG11 ' A' ' 34' ' ' VAL . 6.7 tppt? -72.39 -56.58 5.22 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.246 -171.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.551 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 87.2 mt -57.99 -34.47 70.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.542 0.737 . . . . 0.0 111.261 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.47 ' HG3' ' HB ' ' A' ' 76' ' ' THR . 72.0 ttt180 -59.04 -34.9 72.46 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.07 1.348 . . . . 0.0 112.222 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -94.32 -58.39 2.23 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 122.953 0.501 . . . . 0.0 110.342 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -54.02 -44.43 70.94 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.663 1.185 . . . . 0.0 112.31 -176.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -118.75 -27.22 5.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.25 0.62 . . . . 0.0 112.162 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.8 7.08 64.91 Favored Glycine 0 N--CA 1.471 1.023 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.551 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 99.0 t -75.85 90.36 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.045 0 C-N-CA 124.153 0.981 . . . . 0.0 109.44 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.47 ' HB ' ' HG3' ' A' ' 70' ' ' ARG . 11.4 t -115.2 163.87 15.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.134 0.974 . . . . 0.0 111.069 -174.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 21.71 65.28 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.701 -0.682 . . . . 0.0 113.359 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.409 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 20.6 m -97.97 13.64 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.955 0.902 . . . . 0.0 111.646 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -48.85 -51.01 31.94 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.415 1.486 . . . . 0.0 112.373 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.51 -50.53 72.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.963 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.67 -30.34 71.31 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.29 -177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.6 mt -70.47 -36.18 73.73 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.257 0.623 . . . . 0.0 110.244 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -74.59 -23.96 58.82 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.135 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.79 -13.21 59.93 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.985 0.514 . . . . 0.0 111.752 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 80.3 mt -70.74 158.76 35.72 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.715 0.406 . . . . 0.0 110.734 176.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -136.57 -42.53 0.61 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.05 0.54 . . . . 0.0 110.103 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.418 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 74.9 p -115.71 159.44 21.39 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.315 0.646 . . . . 0.0 111.084 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.458 HG23 ' HB2' ' A' ' 50' ' ' SER . 69.0 t -59.21 -36.69 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.137 177.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -58.52 -35.71 72.7 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.458 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.418 ' HG2' ' OG1' ' A' ' 87' ' ' THR . 37.0 mm-40 -70.52 -37.3 74.09 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.251 0.621 . . . . 0.0 111.743 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.508 ' HG ' HD23 ' A' ' 31' ' ' LEU . 65.7 tp -61.88 -42.53 99.18 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 121.149 0.5 . . . . 0.0 110.607 173.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -63.06 -38.19 90.19 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.436 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 86.8 mm-40 -64.98 -48.27 74.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.913 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.4 tt -53.15 -61.06 2.54 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.532 1.133 . . . . 0.0 110.161 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.464 HG13 HD11 ' A' ' 31' ' ' LEU . 43.7 t -68.63 -31.62 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.236 -173.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.639 ' HG3' HH21 ' A' ' 99' ' ' ARG . 40.3 tt0 -61.05 -45.17 95.87 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.24 0.616 . . . . 0.0 111.086 174.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 74.1 mmtt -67.98 -46.26 71.85 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.869 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -70.06 -24.63 63.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.879 0.471 . . . . 0.0 111.551 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.639 HH21 ' HG3' ' A' ' 96' ' ' GLU . 18.5 ttp180 -66.84 -44.49 80.94 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.856 0.862 . . . . 0.0 109.853 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -89.54 -0.41 57.49 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.61 0.764 . . . . 0.0 111.94 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 65.27 75.0 0.37 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.297 1.439 . . . . 0.0 111.412 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.57 59.44 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 115.159 -0.928 . . . . 0.0 114.932 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.249 1.052 0 C-N-CA 123.254 0.622 . . . . 0.0 109.459 -174.623 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.01 165.44 37.72 Favored Glycine 0 C--N 1.345 1.042 0 N-CA-C 111.798 -0.521 . . . . 0.0 111.798 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.2 p -96.72 115.93 28.26 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.65 0.78 . . . . 0.0 110.184 -178.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.7 t -105.21 172.48 6.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.724 0.81 . . . . 0.0 110.338 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -154.48 161.18 41.81 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.835 0.854 . . . . 0.0 109.75 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -110.94 -172.69 2.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.716 0.806 . . . . 0.0 109.623 173.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -165.95 83.49 0.31 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.792 0.837 . . . . 0.0 109.249 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -63.38 126.88 28.9 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.23 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -141.8 124.4 15.88 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.661 0.784 . . . . 0.0 110.269 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -103.74 155.23 18.75 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.891 0.877 . . . . 0.0 109.182 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.0 p -155.8 34.08 0.35 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.016 0.927 . . . . 0.0 110.123 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.7 m -76.03 179.59 5.52 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.332 1.053 . . . . 0.0 112.121 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 86.84 16.93 60.57 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 123.14 0.4 . . . . 0.0 112.474 -178.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -81.58 125.12 30.15 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.034 0.934 . . . . 0.0 110.114 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -144.98 144.49 31.07 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.737 0.815 . . . . 0.0 110.069 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -155.47 88.8 1.16 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.787 0.835 . . . . 0.0 109.319 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.01 168.48 17.79 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.658 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.1 p90 -150.2 165.29 33.36 Favored 'General case' 0 C--O 1.246 0.902 0 C-N-CA 124.295 1.038 . . . . 0.0 109.946 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -156.29 15.06 0.32 Allowed 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.448 0.642 . . . . 0.0 110.369 173.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -79.08 86.29 4.92 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.874 -0.516 . . . . 0.0 110.066 -177.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.19 82.03 0.06 OUTLIER Glycine 0 C--N 1.34 0.793 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.756 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -159.01 133.56 7.96 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.47 0.708 . . . . 0.0 109.971 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.8 tpt -144.19 87.85 7.68 Favored Pre-proline 0 N--CA 1.478 0.962 0 C-N-CA 124.034 0.934 . . . . 0.0 109.109 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -77.72 86.6 1.62 Allowed 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.744 2.296 . . . . 0.0 111.027 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -136.5 88.75 2.4 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.124 0.569 . . . . 0.0 110.581 -175.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -171.41 157.16 4.8 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.616 1.166 . . . . 0.0 108.465 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.1 tpt -56.96 -63.44 1.21 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.607 1.163 . . . . 0.0 110.782 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.415 ' HA ' HD21 ' A' ' 31' ' ' LEU . 39.1 mt-10 -65.52 -32.67 74.39 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.141 0.976 . . . . 0.0 111.143 -175.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.03 -47.44 71.57 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 124.398 1.061 . . . . 0.0 110.793 172.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.427 ' O ' HG21 ' A' ' 34' ' ' VAL . 7.7 m-70 -72.77 -26.65 61.62 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.437 -175.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD12 HG22 ' A' ' 95' ' ' VAL . 3.5 mm? -60.79 -45.52 94.09 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.731 0.696 . . . . 0.0 109.314 168.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 5.9 mp -66.11 -36.31 82.83 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.478 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -68.25 -42.31 79.84 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.576 0.75 . . . . 0.0 110.682 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.537 HG13 ' HD2' ' A' ' 68' ' ' LYS . 61.3 t -61.13 -49.83 83.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.857 0.463 . . . . 0.0 110.505 178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 90.8 mt -66.74 -39.17 87.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.928 0.767 . . . . 0.0 112.291 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.9 p -65.52 -45.2 84.44 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.154 0.582 . . . . 0.0 111.59 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.0 t -71.13 -30.49 41.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 114.68 -1.145 . . . . 0.0 110.3 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.457 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.62 -37.24 62.87 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.061 0.544 . . . . 0.0 112.203 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.467 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 80.7 p -95.01 -60.95 1.57 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.183 0.593 . . . . 0.0 110.993 -173.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.5 -30.95 2.27 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.003 -177.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -72.12 141.3 83.68 Favored Pre-proline 0 C--N 1.356 0.854 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.899 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.538 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 19.3 Cg_endo -59.47 152.59 60.42 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.457 2.105 . . . . 0.0 112.307 176.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.462 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 13.7 ptmm? -60.78 -20.3 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.426 1.09 . . . . 0.0 112.316 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.63 -35.64 80.67 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.839 0.855 . . . . 0.0 111.32 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.538 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 20.3 mm-40 -75.94 -11.97 60.06 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.684 0.794 . . . . 0.0 111.942 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.432 ' HB ' ' HG ' ' A' ' 32' ' ' LEU . 23.7 mt -98.17 123.12 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 123.056 0.542 . . . . 0.0 110.478 -176.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.7 p -136.1 179.33 6.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.416 1.486 . . . . 0.0 107.692 172.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.495 ' HB2' ' HB2' ' A' ' 89' ' ' ASP . 8.4 ptm180 -52.17 -56.36 15.06 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 123.558 0.743 . . . . 0.0 112.566 177.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -94.61 17.66 12.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.631 -0.668 . . . . 0.0 111.919 -175.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.0 t -70.55 -13.31 62.05 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.079 0.552 . . . . 0.0 111.165 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.441 ' HD3' HG22 ' A' ' 87' ' ' THR . 26.7 mmt180 71.51 177.06 0.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.145 1.378 . . . . 0.0 111.44 175.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.5 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 34.4 mtt -129.44 29.0 5.14 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.654 0.782 . . . . 0.0 111.401 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -56.78 -40.57 76.11 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.595 0.758 . . . . 0.0 110.659 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.03 -23.92 7.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.238 1.015 . . . . 0.0 110.597 174.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.5 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 5.0 mp -77.2 -30.17 54.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.682 0.793 . . . . 0.0 112.82 -166.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.473 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -166.03 89.18 0.4 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.4 0.68 . . . . 0.0 110.499 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -160.22 -33.65 0.06 Allowed 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.942 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -63.92 147.42 52.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.958 0.903 . . . . 0.0 111.424 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -55.76 -44.88 78.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.852 0.861 . . . . 0.0 112.422 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.3 tp -68.68 -39.28 80.63 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.732 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.457 HG13 ' HB1' ' A' ' 38' ' ' ALA . 81.0 t -65.8 -48.91 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 78.4 t -68.32 -38.82 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.753 0.821 . . . . 0.0 111.439 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.491 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 68.4 p -61.96 -55.66 27.13 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -61.65 -27.46 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.626 0.77 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 41.6 tp -64.26 -49.05 73.4 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.149 0.979 . . . . 0.0 109.852 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 85.2 p -68.24 -34.75 76.79 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.568 0.347 . . . . 0.0 111.26 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 63' ' ' SER . 85.1 mt -68.67 -33.09 73.39 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.703 0.801 . . . . 0.0 111.788 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.537 ' HD2' HG13 ' A' ' 34' ' ' VAL . 29.4 ttmt -85.5 -43.72 13.32 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.804 -175.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 94.3 mt -61.25 -27.9 68.78 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.534 0.734 . . . . 0.0 110.766 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -57.69 -40.2 78.91 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.575 1.15 . . . . 0.0 111.065 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -85.48 -45.77 11.5 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.19 0.596 . . . . 0.0 111.105 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.78 -51.96 35.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.129 0.972 . . . . 0.0 111.878 -170.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -123.51 -4.46 8.26 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.311 0.644 . . . . 0.0 112.176 -173.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.72 12.8 84.12 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-O 120.182 -0.232 . . . . 0.0 113.288 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.455 HG13 HG22 ' A' ' 78' ' ' VAL . 57.3 t -86.79 107.13 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.861 0.865 . . . . 0.0 109.406 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 m -136.89 156.33 48.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.447 1.099 . . . . 0.0 109.597 -171.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.04 35.25 90.36 Favored Glycine 0 C--N 1.354 1.549 0 O-C-N 123.672 0.607 . . . . 0.0 111.996 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.455 HG22 HG13 ' A' ' 75' ' ' VAL . 20.5 m -119.62 4.21 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.387 1.075 . . . . 0.0 110.704 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.476 ' HA ' HD11 ' A' ' 82' ' ' LEU . 7.1 p-10 -55.83 -37.94 69.38 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.496 1.119 . . . . 0.0 112.656 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.55 -50.93 71.99 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.789 0.681 . . . . 0.0 110.744 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.76 -23.52 64.33 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.921 -178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.476 HD11 ' HA ' ' A' ' 79' ' ' ASP . 87.7 mt -73.27 -31.26 63.96 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.551 0.741 . . . . 0.0 111.19 175.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.21 -37.37 85.39 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.522 0.514 . . . . 0.0 109.774 171.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.99 -0.26 30.39 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.014 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.502 HD12 HD13 ' A' ' 94' ' ' LEU . 79.6 mt -82.17 144.24 30.87 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 169.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.36 -8.44 2.56 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.992 0.917 . . . . 0.0 110.38 174.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.441 HG22 ' HD3' ' A' ' 51' ' ' ARG . 4.2 m -138.96 147.1 41.79 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.49 ' HA ' ' HE2' ' A' ' 52' ' ' MET . 67.1 t -71.97 -31.91 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.676 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.495 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 38.2 t70 -56.79 -40.62 76.23 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.816 0.846 . . . . 0.0 110.059 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.71 -29.57 64.7 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.979 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.476 ' HB2' ' HE1' ' A' ' 52' ' ' MET . 67.1 tp -64.19 -45.52 87.98 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.218 0.607 . . . . 0.0 111.162 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -58.64 -45.55 89.06 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.682 0.614 . . . . 0.0 109.653 177.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 19.0 mm100 -61.78 -38.59 88.64 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.293 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.502 HD13 HD12 ' A' ' 85' ' ' LEU . 9.6 tt -62.68 -61.79 2.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.042 0.937 . . . . 0.0 110.207 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.454 HG11 HG23 ' A' ' 75' ' ' VAL . 92.5 t -60.6 -44.53 97.02 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.129 -172.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -66.45 -35.62 80.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -67.36 -38.06 84.19 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.693 0.224 . . . . 0.0 111.475 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -84.34 -17.67 38.71 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.008 0.523 . . . . 0.0 111.981 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -82.3 -48.46 11.17 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.52 37.29 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.61 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 62.84 -167.7 0.21 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.685 1.194 . . . . 0.0 111.09 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -178.41 56.05 0.09 OUTLIER Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.254 1.32 0 C-N-CA 123.447 0.699 . . . . 0.0 109.384 -179.687 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptt? . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.7 34.78 0.03 OUTLIER Glycine 0 C--N 1.345 1.043 0 CA-C-N 116.213 -0.448 . . . . 0.0 113.128 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 66.2 p -76.14 123.75 26.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.26 0.624 . . . . 0.0 109.901 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.2 p -148.91 112.02 4.91 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.258 0.623 . . . . 0.0 109.694 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -132.24 140.05 48.51 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.318 1.047 . . . . 0.0 109.374 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -85.02 -176.7 6.31 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.58 0.752 . . . . 0.0 111.282 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 -152.23 133.86 14.66 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 172.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 p-80 -144.17 120.55 10.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.014 0.526 . . . . 0.0 110.072 177.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -144.76 148.07 33.67 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.282 1.033 . . . . 0.0 108.838 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 p80 -134.48 105.57 6.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.28 0.632 . . . . 0.0 109.396 178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.6 p -80.19 77.66 6.9 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 173.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.8 p -105.45 133.6 49.94 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 124.462 1.105 . . . . 0.0 109.898 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -147.5 165.47 28.72 Favored Glycine 0 C--N 1.34 0.802 0 O-C-N 123.099 0.249 . . . . 0.0 112.804 -177.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -124.7 168.92 12.52 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.236 1.014 . . . . 0.0 109.051 174.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.87 127.44 32.63 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.248 0.619 . . . . 0.0 110.062 175.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -71.4 -62.83 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.044 0.538 . . . . 0.0 110.528 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 mp -105.96 159.48 16.01 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.202 1.001 . . . . 0.0 109.884 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -135.47 174.76 10.25 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.862 1.265 . . . . 0.0 108.458 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -110.29 117.93 34.97 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -80.22 111.47 16.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.23 0.612 . . . . 0.0 109.611 -177.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.45 166.68 40.42 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.973 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -78.74 -68.94 0.6 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.309 1.044 . . . . 0.0 110.067 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 87.8 mtp -141.66 102.78 5.9 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.028 0.931 . . . . 0.0 108.728 177.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -80.22 56.69 6.17 Favored 'Trans proline' 0 C--N 1.372 1.772 0 C-N-CA 123.171 2.58 . . . . 0.0 112.623 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -61.18 -61.85 2.27 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.058 0.943 . . . . 0.0 109.509 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -155.42 -78.68 0.09 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.313 169.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.6 ptm -54.77 -35.36 63.71 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -166.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.2 -56.13 16.87 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.36 -35.53 80.59 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.034 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -70.5 -51.66 27.39 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.955 0.902 . . . . 0.0 110.742 -169.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HA ' HG11 ' A' ' 34' ' ' VAL . 4.1 mm? -66.95 -33.76 76.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.331 0.395 . . . . 0.0 110.154 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.5 -32.79 74.58 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 110.588 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.401 ' O ' HG22 ' A' ' 37' ' ' VAL . 97.8 m -71.93 -51.32 22.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.427 0.691 . . . . 0.0 111.018 178.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.455 HG11 ' HA ' ' A' ' 31' ' ' LEU . 13.3 p -62.46 -31.65 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 122.208 0.203 . . . . 0.0 110.819 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.53 HD11 HD21 ' A' ' 91' ' ' LEU . 87.1 mt -73.16 -34.2 65.9 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.252 0.621 . . . . 0.0 111.439 173.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.6 t -64.64 -36.6 84.77 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.371 0.668 . . . . 0.0 111.12 177.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 33' ' ' THR . 22.0 t -82.77 -25.29 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.517 0.727 . . . . 0.0 110.224 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.498 ' HB1' HG11 ' A' ' 61' ' ' VAL . . . -74.56 -43.71 54.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.45 0.7 . . . . 0.0 111.453 178.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.8 p -86.94 -50.39 6.71 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.758 0.823 . . . . 0.0 110.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 122.78 -33.04 4.23 Favored Glycine 0 C--N 1.341 0.817 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.007 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.1 m -73.43 130.17 84.54 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 123.006 0.522 . . . . 0.0 111.124 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -54.77 157.53 12.52 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.397 2.731 . . . . 0.0 114.151 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -56.85 -27.4 60.24 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.358 1.063 . . . . 0.0 112.463 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -68.17 -21.37 64.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.757 0.823 . . . . 0.0 111.801 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -105.33 2.98 29.36 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.541 0.737 . . . . 0.0 111.545 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -113.04 120.91 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.293 0.637 . . . . 0.0 109.307 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.6 m -100.85 167.31 10.36 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.318 0.647 . . . . 0.0 109.302 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -71.29 -19.41 62.34 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.836 0.35 . . . . 0.0 110.757 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -123.23 79.23 1.65 Allowed 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.4 m -125.08 20.27 8.26 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.549 1.14 . . . . 0.0 108.929 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 56.08 -169.84 0.09 Allowed 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 112.312 -170.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.447 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 49.8 ttm -147.24 84.8 1.58 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.577 0.703 . . . . 0.0 109.254 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.36 -4.13 8.37 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.608 174.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -137.18 -36.41 0.66 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.333 0.653 . . . . 0.0 110.63 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 69.6 mt -66.64 -36.85 83.56 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -167.65 79.81 0.18 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.526 0.73 . . . . 0.0 110.142 177.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -147.76 -15.79 0.37 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.468 0.307 . . . . 0.0 111.327 -175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -91.7 150.22 21.24 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.719 0.808 . . . . 0.0 109.338 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -54.04 -45.86 71.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.92 0.888 . . . . 0.0 112.616 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.05 -36.1 74.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.716 0.407 . . . . 0.0 110.551 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.498 HG11 ' HB1' ' A' ' 38' ' ' ALA . 38.4 t -71.3 -40.35 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.214 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 51.3 t -69.81 -39.8 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.915 0.886 . . . . 0.0 110.291 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.474 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 41.5 t -64.37 -46.31 83.92 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.634 0.584 . . . . 0.0 110.264 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -62.19 -43.43 98.86 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.975 0.797 . . . . 0.0 110.563 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.57 -49.34 72.98 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.929 173.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.9 t -65.64 -22.79 66.69 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.159 0.984 . . . . 0.0 112.081 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 63' ' ' SER . 91.1 mt -67.61 -52.12 42.21 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -26.12 61.26 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.36 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.585 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 30.8 mt -67.79 -46.26 72.5 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 174.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -63.28 -42.24 99.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.023 0.929 . . . . 0.0 110.515 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -69.64 -46.4 66.25 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.51 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.33 -49.53 4.22 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.82 -168.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -97.75 -11.64 23.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.377 0.671 . . . . 0.0 111.982 -174.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.02 8.66 86.92 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 123.328 0.392 . . . . 0.0 113.968 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 46.2 t -86.46 108.21 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.35 0.66 . . . . 0.0 110.529 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.0 t -150.31 167.24 27.6 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.99 0.916 . . . . 0.0 109.756 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 24.32 75.14 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 112.046 -0.422 . . . . 0.0 112.046 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 75' ' ' VAL . 31.6 m -126.09 18.19 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.431 1.092 . . . . 0.0 110.965 -172.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -51.85 -40.92 61.36 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.586 1.154 . . . . 0.0 113.2 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -70.1 -39.41 75.53 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.009 0.924 . . . . 0.0 110.681 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.26 -33.08 71.18 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.394 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.94 -29.84 62.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.715 0.806 . . . . 0.0 111.094 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -73.05 -32.54 65.12 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.969 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.41 -17.86 61.77 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.637 0.775 . . . . 0.0 110.632 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.04 132.96 55.05 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.218 0.607 . . . . 0.0 111.849 177.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.26 -6.55 5.37 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.985 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.6 p -139.94 154.35 47.19 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.412 0.625 . . . . 0.0 111.398 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.4 t -68.58 -40.81 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.771 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.477 ' HA ' ' HD2' ' A' ' 92' ' ' PHE . 9.4 t70 -64.94 -30.21 71.19 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.755 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.26 -41.38 81.16 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.259 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.53 HD21 HD11 ' A' ' 35' ' ' LEU . 59.6 tp -62.63 -42.08 99.39 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 123.464 0.477 . . . . 0.0 111.036 175.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.477 ' HD2' ' HA ' ' A' ' 89' ' ' ASP . 27.0 m-85 -54.57 -48.77 71.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.868 0.467 . . . . 0.0 110.525 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.472 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 79.7 mt-30 -68.96 -37.79 79.03 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.555 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.8 tt -57.46 -55.88 29.04 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.904 0.882 . . . . 0.0 110.2 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.4 HG22 HD13 ' A' ' 31' ' ' LEU . 84.9 t -61.26 -42.55 93.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.491 -178.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -56.67 -42.44 79.01 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.266 0.979 . . . . 0.0 110.771 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 33.4 mmtp -66.64 -47.29 73.04 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.687 0.395 . . . . 0.0 111.737 -178.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -74.96 -18.43 60.39 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.976 0.51 . . . . 0.0 112.043 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -82.64 -55.41 4.47 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.539 0.736 . . . . 0.0 109.955 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.31 -26.69 62.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.751 0.82 . . . . 0.0 111.594 -176.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -106.23 92.78 4.28 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.81 74.19 1.17 Allowed Glycine 0 C--N 1.348 1.238 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.556 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.1 p . . . . . 0 C--O 1.253 1.253 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -173.331 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.13 79.73 1.58 Allowed Glycine 0 C--N 1.353 1.484 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -133.37 24.49 4.12 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.689 0.796 . . . . 0.0 110.642 -172.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.1 p -88.46 105.48 17.64 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.121 0.569 . . . . 0.0 110.784 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.4 m170 -79.46 123.13 27.26 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -99.12 149.31 23.18 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -108.7 61.19 0.6 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.949 0.9 . . . . 0.0 109.863 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -68.34 96.73 0.68 Allowed 'General case' 0 C--N 1.352 0.705 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -101.96 125.81 48.72 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.909 0.883 . . . . 0.0 110.384 -176.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -159.97 -33.13 0.06 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.494 1.118 . . . . 0.0 109.291 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.0 m -65.99 114.5 5.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.504 0.722 . . . . 0.0 109.673 172.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -132.08 147.89 52.46 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.481 0.712 . . . . 0.0 110.323 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.62 121.55 22.5 Favored Glycine 0 C--N 1.344 1.001 0 O-C-N 124.271 0.982 . . . . 0.0 112.632 -175.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -84.22 -68.15 0.74 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.681 0.792 . . . . 0.0 109.101 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 52.27 26.89 4.29 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 125.443 1.497 . . . . 0.0 111.445 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -81.48 102.42 10.55 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.163 0.985 . . . . 0.0 109.526 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp 58.77 36.78 24.99 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.242 1.017 . . . . 0.0 111.025 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -87.2 76.69 9.18 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.355 -176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -102.93 103.77 13.93 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.756 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -84.04 -62.92 1.45 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 61.09 -90.68 0.05 OUTLIER Glycine 0 C--N 1.352 1.431 0 O-C-N 124.441 1.088 . . . . 0.0 112.981 177.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -99.77 23.86 9.11 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.212 1.005 . . . . 0.0 111.169 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 tpt -125.97 72.48 70.04 Favored Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 170.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -98.58 -156.84 0.04 OUTLIER 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.557 2.838 . . . . 0.0 112.15 177.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 69.82 -82.73 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.129 1.372 . . . . 0.0 110.389 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.8 t70 9.39 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 128.144 2.578 . . . . 0.0 114.874 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 23.1 ptm -130.31 -45.15 1.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.593 0.757 . . . . 0.0 110.341 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.461 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 42.9 mt-10 -59.05 -57.15 14.35 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.491 0.716 . . . . 0.0 112.767 -167.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.68 -25.29 67.88 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.984 0.803 . . . . 0.0 111.816 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.462 ' O ' HG22 ' A' ' 34' ' ' VAL . 40.1 m80 -67.93 -45.41 74.4 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.64 0.587 . . . . 0.0 110.287 171.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.496 HD22 HG21 ' A' ' 95' ' ' VAL . 7.4 mp -67.26 -28.93 68.44 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.544 0.337 . . . . 0.0 111.495 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.523 ' HA ' HG22 ' A' ' 46' ' ' ILE . 8.4 mp -63.24 -38.7 92.18 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.696 0.399 . . . . 0.0 109.991 172.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -73.99 -34.11 64.07 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.086 0.866 . . . . 0.0 110.656 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 30' ' ' HIS . 55.4 t -63.06 -58.06 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.141 0.576 . . . . 0.0 110.2 178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.42 -40.77 97.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.548 0.739 . . . . 0.0 111.455 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.9 p -63.2 -56.9 12.8 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.467 0.479 . . . . 0.0 111.32 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.1 t -67.44 -41.38 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 C-N-CA 123.336 0.654 . . . . 0.0 111.271 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.69 -28.2 68.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.208 0.603 . . . . 0.0 112.145 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.9 m -92.9 -25.63 17.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.968 0.507 . . . . 0.0 111.394 177.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.88 17.15 58.53 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 123.001 0.334 . . . . 0.0 112.915 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.4 m -102.11 160.76 25.46 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 124.617 1.167 . . . . 0.0 109.945 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -70.23 158.67 55.62 Favored 'Trans proline' 0 C--N 1.368 1.595 0 C-N-CA 122.323 2.015 . . . . 0.0 112.692 168.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -64.76 -20.01 66.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.81 0.844 . . . . 0.0 111.182 173.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.94 -31.52 65.05 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.286 1.034 . . . . 0.0 110.97 173.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -96.4 15.84 20.2 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.99 0.916 . . . . 0.0 111.104 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.523 HG22 ' HA ' ' A' ' 32' ' ' LEU . 21.1 mm -123.46 141.11 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.69 0.796 . . . . 0.0 109.621 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 p -155.43 -168.6 2.88 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.173 0.989 . . . . 0.0 109.706 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.457 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 62.0 mtp85 -75.18 -9.09 58.23 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 176.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -162.71 92.93 0.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 161.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.7 t -106.27 14.13 27.89 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.191 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.673 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 44.8 mmt-85 60.84 104.5 0.02 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 124.37 1.068 . . . . 0.0 111.757 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.459 ' SD ' HD22 ' A' ' 91' ' ' LEU . 71.4 mtm -74.38 -2.16 24.13 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.936 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.673 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 12.7 pt-20 -61.06 -31.41 71.06 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.144 0.578 . . . . 0.0 110.908 173.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -87.51 -39.53 15.09 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.766 0.826 . . . . 0.0 109.986 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 25.9 mt -81.87 -86.49 0.1 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.724 -171.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -104.44 80.37 1.68 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.497 0.719 . . . . 0.0 110.199 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -145.0 -11.05 0.57 Allowed 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.809 -177.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.45 148.02 26.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -53.8 -40.23 66.16 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.164 0.985 . . . . 0.0 112.638 -174.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -74.39 -39.03 62.94 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.09 0.556 . . . . 0.0 110.708 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 22.7 t -70.9 -37.23 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 116.795 -0.184 . . . . 0.0 110.983 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.4 t -68.62 -34.03 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 123.583 0.753 . . . . 0.0 110.011 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.1 t -67.22 -42.15 84.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.876 0.47 . . . . 0.0 110.73 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.86 -23.09 52.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.084 0.954 . . . . 0.0 111.643 177.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.13 -50.28 42.16 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 173.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.5 t -60.96 -41.96 97.35 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.48 1.112 . . . . 0.0 110.772 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.0 tp -57.93 -48.87 78.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.539 1.136 . . . . 0.0 110.715 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -68.33 -40.85 81.48 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.141 0.976 . . . . 0.0 111.073 -175.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.415 ' HA ' ' HD1' ' A' ' 73' ' ' PHE . 90.1 mt -65.13 -41.57 94.71 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.499 0.72 . . . . 0.0 110.591 179.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -70.59 -34.69 72.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.67 0.788 . . . . 0.0 111.121 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -77.78 -62.74 1.57 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.963 0.505 . . . . 0.0 111.461 -172.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.15 -50.89 17.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.911 0.485 . . . . 0.0 111.836 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.415 ' HD1' ' HA ' ' A' ' 69' ' ' LEU . 32.8 m-85 -91.92 -31.02 15.81 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.256 0.623 . . . . 0.0 111.689 -168.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.79 5.79 80.78 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.741 -173.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.639 HG21 HG12 ' A' ' 95' ' ' VAL . 88.3 t -77.11 87.68 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 122.106 0.955 . . . . 0.0 109.638 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.0 m -101.68 162.06 13.19 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 114.063 -1.426 . . . . 0.0 109.928 -177.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.84 38.85 93.26 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 123.503 0.502 . . . . 0.0 113.094 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.469 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 17.4 m -113.89 5.16 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.971 0.909 . . . . 0.0 111.443 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.59 -46.18 84.33 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.855 1.262 . . . . 0.0 112.723 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.48 -37.74 87.72 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.483 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.538 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 7.6 mp0 -66.69 -40.46 88.54 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.615 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 85.3 mt -59.98 -37.13 78.72 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.568 0.747 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.53 -38.63 87.57 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.059 174.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.03 -20.7 59.47 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.26 0.624 . . . . 0.0 111.719 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 95.5 mt -84.09 154.02 23.43 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.443 0.697 . . . . 0.0 112.066 -176.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 87' ' ' THR . 9.3 pt-20 -136.48 -37.61 0.69 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 109.196 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.516 HG22 ' HG3' ' A' ' 86' ' ' GLU . 11.9 p -102.56 143.28 32.46 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 125.675 1.59 . . . . 0.0 110.538 -173.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.3 t -77.81 -25.81 14.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.173 -173.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -64.81 -39.88 94.3 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.569 0.699 . . . . 0.0 109.854 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.492 ' HA ' HE21 ' A' ' 93' ' ' GLN . 3.9 mp0 -65.47 -36.27 83.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.921 173.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.459 HD22 ' SD ' ' A' ' 52' ' ' MET . 63.7 tp -66.4 -35.25 79.86 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.998 0.519 . . . . 0.0 111.397 172.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.461 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.5 m-85 -66.16 -51.73 55.05 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.285 0.634 . . . . 0.0 110.506 178.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.492 HE21 ' HA ' ' A' ' 90' ' ' GLU . 29.4 pt20 -70.08 -18.51 63.26 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.566 0.347 . . . . 0.0 111.513 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 85' ' ' LEU . 64.9 tp -68.99 -47.7 64.92 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.962 0.505 . . . . 0.0 110.614 171.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.639 HG12 HG21 ' A' ' 75' ' ' VAL . 75.9 t -64.56 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.53 0.732 . . . . 0.0 110.229 176.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.419 ' HB3' ' HA ' ' A' ' 93' ' ' GLN . 33.1 tt0 -60.94 -40.8 94.68 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.543 1.137 . . . . 0.0 110.688 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 6.6 tmtt? -63.58 -44.04 95.2 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.301 1.04 . . . . 0.0 109.71 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.8 -24.28 52.81 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.45 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -86.98 -39.05 16.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 123.339 0.399 . . . . 0.0 110.985 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.69 -56.64 4.26 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.461 0.704 . . . . 0.0 109.917 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.11 113.16 22.62 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.82 99.12 0.07 OUTLIER Glycine 0 C--N 1.353 1.496 0 O-C-N 124.441 1.088 . . . . 0.0 113.963 -171.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 C--O 1.245 0.843 0 C-N-CA 123.67 0.788 . . . . 0.0 109.08 178.097 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.6 ttm . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -91.17 -148.86 22.43 Favored Glycine 0 C--N 1.342 0.914 0 N-CA-C 112.332 -0.307 . . . . 0.0 112.332 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 m -148.92 118.88 7.13 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 109.168 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.3 t -143.49 99.52 3.44 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.153 0.581 . . . . 0.0 109.965 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -157.9 150.96 23.03 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 171.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -78.42 139.46 38.74 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -85.27 -19.27 31.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.231 0.612 . . . . 0.0 111.432 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 22.7 t-80 -91.32 11.23 24.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.199 0.599 . . . . 0.0 111.818 -173.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -63.33 102.41 0.4 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.968 0.507 . . . . 0.0 110.121 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -121.89 142.98 49.72 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.979 0.912 . . . . 0.0 110.176 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.7 t -100.38 162.78 12.72 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 123.399 0.68 . . . . 0.0 109.846 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.3 p -81.98 108.84 15.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.269 0.628 . . . . 0.0 109.469 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -134.5 -75.21 0.09 OUTLIER Glycine 0 C--N 1.344 1.0 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 52.21 89.12 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.035 1.334 . . . . 0.0 112.158 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.63 145.91 55.48 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.8 0.84 . . . . 0.0 110.681 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -60.0 -33.24 71.71 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 123.941 0.776 . . . . 0.0 110.767 -174.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 tt -123.35 99.66 6.45 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 174.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -119.03 21.79 12.2 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.448 0.699 . . . . 0.0 110.719 -175.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -61.43 -31.79 71.74 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.78 0.832 . . . . 0.0 111.976 -171.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -70.87 143.14 51.13 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.776 0.831 . . . . 0.0 110.265 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.29 -30.3 6.82 Favored Glycine 0 C--N 1.342 0.878 0 N-CA-C 112.11 -0.396 . . . . 0.0 112.11 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -75.41 112.67 11.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.878 0.471 . . . . 0.0 110.155 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -103.0 142.3 24.28 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 168.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -78.03 -4.25 14.22 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.813 2.342 . . . . 0.0 112.214 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 -73.55 89.97 1.73 Allowed 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.053 0.941 . . . . 0.0 109.414 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.419 ' HB3' ' HB3' ' A' ' 29' ' ' ASP . 22.8 t70 -168.66 170.96 9.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.154 0.982 . . . . 0.0 108.776 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.1 tpt -84.11 -62.22 1.62 Allowed 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 174.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 44.4 mt-10 -62.71 -56.84 14.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.697 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.419 ' HB3' ' HB3' ' A' ' 26' ' ' ASP . 25.3 t70 -58.82 -37.24 75.96 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 124.518 1.136 . . . . 0.0 111.752 -173.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -67.94 -45.45 74.25 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.275 0.63 . . . . 0.0 111.141 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -70.14 -28.62 65.51 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.412 HD12 HD11 ' A' ' 35' ' ' LEU . 9.4 tp -73.82 -27.04 60.91 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.269 1.028 . . . . 0.0 109.903 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.513 ' HA ' ' HG ' ' A' ' 36' ' ' SER . 63.4 m -70.32 -42.38 72.0 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.741 0.816 . . . . 0.0 109.606 173.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.54 -42.95 77.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.313 0.645 . . . . 0.0 110.525 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.412 HD11 HD12 ' A' ' 32' ' ' LEU . 90.1 mt -67.58 -39.67 84.84 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.11 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.513 ' HG ' ' HA ' ' A' ' 33' ' ' THR . 76.4 p -71.6 -29.33 64.57 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.843 0.457 . . . . 0.0 111.191 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -75.15 -40.07 43.77 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 C-N-CA 123.063 0.545 . . . . 0.0 110.312 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.44 -35.55 75.78 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.747 0.819 . . . . 0.0 112.023 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.496 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 78.1 p -91.81 -55.6 3.41 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.267 0.627 . . . . 0.0 110.766 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.61 -26.85 5.88 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.072 -175.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.67 148.75 66.34 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.347 0.659 . . . . 0.0 110.408 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.471 ' HD2' ' HG3' ' A' ' 45' ' ' GLU . 76.7 Cg_exo -53.55 159.21 6.73 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 123.396 2.731 . . . . 0.0 113.99 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.664 ' HZ3' ' HB2' ' A' ' 43' ' ' LYS . 8.8 mtmp? -60.42 -36.42 78.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.986 0.914 . . . . 0.0 110.692 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.02 -8.75 57.97 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.057 0.943 . . . . 0.0 112.046 -177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.471 ' HG3' ' HD2' ' A' ' 42' ' ' PRO . 34.6 mm-40 -90.89 -3.79 57.06 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.647 0.779 . . . . 0.0 110.743 170.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.4 mt -115.45 138.71 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.157 0.983 . . . . 0.0 109.323 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -133.77 161.98 33.23 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.007 0.923 . . . . 0.0 108.667 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.71 -34.6 78.21 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.8 -20.16 60.97 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.926 1.291 . . . . 0.0 112.445 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -74.05 155.99 37.95 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.263 1.025 . . . . 0.0 111.429 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -91.87 176.47 6.51 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.622 0.769 . . . . 0.0 110.326 173.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.465 ' HE1' ' HB2' ' A' ' 91' ' ' LEU . 55.3 mtt -110.58 111.97 23.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.687 0.795 . . . . 0.0 110.639 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -135.51 -53.33 0.77 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 174.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.95 -38.07 9.14 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.072 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.496 ' HA ' ' HB3' ' A' ' 39' ' ' SER . 56.5 mt -66.28 -43.14 87.21 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.552 -170.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.55 84.95 0.17 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.976 0.798 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -152.56 -48.23 0.1 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.319 0.248 . . . . 0.0 110.54 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.92 144.14 57.03 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.56 0.538 . . . . 0.0 110.048 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.7 p -55.7 -44.74 77.67 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 111.702 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.88 -40.03 94.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.688 0.795 . . . . 0.0 111.087 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 93.1 t -62.81 -43.5 98.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.03 0.532 . . . . 0.0 110.724 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.67 -30.83 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.031 0.933 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.0 m -66.46 -42.73 87.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.479 0.712 . . . . 0.0 110.108 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.41 -32.56 64.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.163 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.92 -46.18 82.74 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 0.0 110.317 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.0 p -70.61 -30.45 67.11 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.689 0.796 . . . . 0.0 111.028 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.54 -39.11 85.01 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.713 0.805 . . . . 0.0 109.619 173.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 5.9 mptp? -66.49 -44.12 83.53 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 123.521 0.728 . . . . 0.0 109.515 174.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.3 mt -64.0 -27.03 68.84 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.357 0.411 . . . . 0.0 111.259 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -49.49 77.62 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.434 0.693 . . . . 0.0 110.147 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -72.21 -43.39 64.53 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.377 -175.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 15.1 mm-40 -82.61 -52.32 6.92 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.693 0.797 . . . . 0.0 111.102 -168.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -126.31 0.57 7.04 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -171.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 70.47 6.47 58.39 Favored Glycine 0 N--CA 1.478 1.489 0 CA-C-O 119.777 -0.457 . . . . 0.0 114.031 -177.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 90.6 t -80.4 124.2 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.161 0.984 . . . . 0.0 110.674 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.2 m -149.0 155.72 41.21 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.715 0.806 . . . . 0.0 109.798 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.43 -18.2 57.47 Favored Glycine 0 C--N 1.348 1.223 0 CA-C-N 116.421 -0.354 . . . . 0.0 112.518 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.1 m -79.84 8.42 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 124.543 1.137 . . . . 0.0 112.144 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.35 -40.39 61.9 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.745 1.218 . . . . 0.0 112.145 -176.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.04 -46.3 81.87 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.978 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -68.66 -28.58 67.01 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.042 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.59 -37.8 77.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.103 0.961 . . . . 0.0 109.806 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.44 -32.25 73.79 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.255 174.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -79.18 -16.45 56.58 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.1 mt -70.75 138.45 50.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.586 0.354 . . . . 0.0 110.205 175.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -125.79 -11.53 6.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.531 0.732 . . . . 0.0 109.581 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.419 ' HB ' ' HG3' ' A' ' 90' ' ' GLU . 2.0 m -135.9 146.91 47.88 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 123.081 0.552 . . . . 0.0 109.979 -175.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.39 -30.32 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.267 -174.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -52.5 -49.12 65.39 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 123.48 0.488 . . . . 0.0 110.459 170.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.419 ' HG3' ' HB ' ' A' ' 87' ' ' THR . 47.4 mt-10 -61.16 -40.15 92.78 Favored 'General case' 0 C--N 1.35 0.6 0 O-C-N 124.499 1.124 . . . . 0.0 110.877 -176.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.465 ' HB2' ' HE1' ' A' ' 52' ' ' MET . 56.6 tp -62.73 -48.66 78.25 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.707 0.63 . . . . 0.0 111.785 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.436 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 9.3 m-85 -58.18 -39.1 78.04 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.485 0.49 . . . . 0.0 110.693 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -77.31 -31.83 54.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.662 0.601 . . . . 0.0 111.46 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.31 -55.38 8.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.18 0.592 . . . . 0.0 109.925 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.3 -43.92 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.482 1.113 . . . . 0.0 110.634 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -63.54 -40.93 98.29 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.973 0.796 . . . . 0.0 111.289 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.85 -29.39 66.62 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.201 0.6 . . . . 0.0 111.083 -177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -78.4 -36.97 45.07 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.626 0.77 . . . . 0.0 110.959 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.88 -37.42 55.55 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.512 1.125 . . . . 0.0 110.868 -176.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.76 -46.35 11.49 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.551 0.74 . . . . 0.0 109.902 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 58.83 -164.13 0.21 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 124.754 1.222 . . . . 0.0 112.305 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 122.88 -67.44 0.48 Allowed Glycine 0 C--N 1.348 1.222 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.25 1.102 0 C-N-CA 123.834 0.854 . . . . 0.0 109.336 -179.854 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 129.91 160.5 10.14 Favored Glycine 0 C--N 1.349 1.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.308 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.1 t -163.13 139.65 7.24 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.51 0.724 . . . . 0.0 109.726 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p -79.29 -11.6 59.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.787 0.835 . . . . 0.0 111.262 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 71.32 -176.92 0.2 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.643 1.577 . . . . 0.0 112.009 177.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -71.09 155.05 41.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.095 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -141.64 87.32 2.05 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -70.23 119.15 13.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.151 -174.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -121.54 140.89 51.64 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.113 0.965 . . . . 0.0 109.204 176.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -80.73 108.35 14.31 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 25.6 m -87.4 29.32 0.87 Allowed 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.147 0.979 . . . . 0.0 110.924 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 p -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.73 1.212 . . . . 0.0 112.01 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.4 -133.62 0.64 Allowed Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.504 -0.609 . . . . 0.0 111.933 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 59.07 70.72 0.63 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.248 1.019 . . . . 0.0 110.393 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -107.48 12.99 27.31 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.771 1.228 . . . . 0.0 110.454 -177.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -84.0 30.47 0.52 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.78 1.232 . . . . 0.0 112.525 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.9 tp 73.5 145.41 0.08 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.27 1.428 . . . . 0.0 111.352 -179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -74.44 131.46 41.08 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.764 0.826 . . . . 0.0 110.664 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -63.04 109.12 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.472 0.709 . . . . 0.0 110.618 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.412 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 1.6 pp0? -128.93 119.79 24.99 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.7 0.8 . . . . 0.0 109.589 176.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.12 59.52 0.84 Allowed Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.965 -1.254 . . . . 0.0 109.965 171.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 65.28 -73.6 0.06 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.4 1.48 . . . . 0.0 109.529 -169.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 mtm -113.46 95.65 36.92 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 168.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.412 ' HB3' ' HA ' ' A' ' 20' ' ' GLN . 70.4 Cg_endo -79.75 53.27 4.66 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 123.414 2.743 . . . . 0.0 113.4 -175.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.414 HD21 ' N ' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -146.36 138.61 25.08 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.749 0.819 . . . . 0.0 109.121 179.069 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -167.5 169.65 11.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -176.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.6 -46.9 80.6 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.18 0.592 . . . . 0.0 110.826 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -61.74 -40.03 93.65 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.29 0.994 . . . . 0.0 110.918 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.4 -43.09 95.49 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -69.03 -37.06 78.41 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.638 0.775 . . . . 0.0 110.801 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.2 tp -71.25 -39.39 71.64 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.289 0.636 . . . . 0.0 111.071 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.732 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 9.2 mp -69.0 -32.48 72.06 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.843 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.7 m -70.58 -34.35 72.09 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.696 0.399 . . . . 0.0 110.713 173.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.59 HG12 ' HB3' ' A' ' 68' ' ' LYS . 20.4 t -56.83 -46.87 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.361 0.664 . . . . 0.0 109.772 172.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -68.3 -36.68 79.71 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.962 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.3 p -68.33 -36.16 78.86 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.826 0.45 . . . . 0.0 111.751 -176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.3 -27.63 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.261 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.37 -41.72 63.06 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.162 0.585 . . . . 0.0 111.341 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.3 p -91.2 -63.07 1.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.468 0.707 . . . . 0.0 111.137 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.55 -38.58 1.56 Allowed Glycine 0 C--N 1.343 0.971 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -68.37 141.91 94.01 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.347 0.659 . . . . 0.0 110.368 175.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.434 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 56.6 Cg_endo -67.08 158.16 58.19 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.795 2.33 . . . . 0.0 111.639 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.732 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 20.5 pttm -68.15 -18.41 64.61 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.24 -31.11 65.2 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 124.226 1.011 . . . . 0.0 111.668 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 15.7 mm-40 -85.57 -23.98 27.41 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.865 0.866 . . . . 0.0 111.502 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -87.16 142.45 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 123.586 0.754 . . . . 0.0 111.051 -172.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.0 t -150.15 177.94 9.44 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.522 1.129 . . . . 0.0 109.195 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.7 mtt-85 -69.86 -24.7 63.47 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.87 0.468 . . . . 0.0 110.599 172.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -65.8 -32.39 73.9 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.102 0.876 . . . . 0.0 110.814 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.8 m -60.34 106.64 0.55 Allowed 'General case' 0 C--N 1.357 0.917 0 O-C-N 124.337 1.023 . . . . 0.0 110.551 -177.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.4 mtt-85 -81.4 155.48 25.88 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 169.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.8 mmt -69.68 90.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.789 0.68 . . . . 0.0 109.823 -176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -103.11 -18.09 15.1 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.276 1.03 . . . . 0.0 110.404 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -155.35 -47.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.949 1.3 . . . . 0.0 107.703 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.424 HD11 ' H ' ' A' ' 55' ' ' LEU . 1.6 mp -59.23 122.68 14.45 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.588 172.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.548 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . 53.75 21.88 2.9 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.098 0.959 . . . . 0.0 113.557 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -115.78 19.49 15.16 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 121.774 0.797 . . . . 0.0 111.41 -172.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -147.79 149.12 31.76 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 172.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.3 p -50.0 -42.65 49.53 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.972 1.309 . . . . 0.0 113.147 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.3 -38.19 74.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 110.87 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.2 t -76.15 -28.49 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.424 0.69 . . . . 0.0 111.304 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.503 HG12 ' HB2' ' A' ' 82' ' ' LEU . 60.1 t -73.07 -43.26 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 124.096 0.959 . . . . 0.0 109.456 175.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.4 t -60.96 -43.06 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.838 0.711 . . . . 0.0 110.053 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.65 -38.32 89.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.377 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.548 HD22 ' HB2' ' A' ' 56' ' ' ALA . 45.2 tp -64.23 -45.51 87.89 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 124.143 0.902 . . . . 0.0 110.521 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.6 t -65.44 -44.53 86.98 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.627 0.771 . . . . 0.0 111.292 -177.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.6 mt -67.53 -30.89 70.66 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.795 0.838 . . . . 0.0 111.219 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.59 ' HB3' HG12 ' A' ' 34' ' ' VAL . 5.5 tppt? -72.84 -46.24 54.02 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 123.79 0.681 . . . . 0.0 109.409 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 98.9 mt -62.73 -32.17 73.23 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.637 174.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -67.28 -30.16 69.95 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.627 1.171 . . . . 0.0 111.803 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -93.4 -48.95 6.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.833 0.453 . . . . 0.0 110.658 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -65.05 -53.86 39.23 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.992 0.807 . . . . 0.0 111.334 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -110.37 -23.5 11.15 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.421 0.688 . . . . 0.0 112.088 -172.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.34 13.91 64.91 Favored Glycine 0 N--CA 1.478 1.477 0 CA-C-N 117.739 0.245 . . . . 0.0 112.837 -172.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.603 HG21 HG13 ' A' ' 95' ' ' VAL . 96.4 t -91.6 115.88 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.41 0.684 . . . . 0.0 110.224 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 15.2 t -149.27 169.68 20.21 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 124.247 1.019 . . . . 0.0 109.598 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.48 -2.79 87.63 Favored Glycine 0 C--N 1.345 1.057 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.564 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 27.8 m -98.36 17.75 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.699 1.2 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.58 -53.56 29.53 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.296 1.438 . . . . 0.0 112.172 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.15 -39.68 87.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.03 -23.05 61.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.992 0.917 . . . . 0.0 111.233 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.503 ' HB2' HG12 ' A' ' 62' ' ' VAL . 81.7 mt -71.59 -33.48 69.09 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.404 0.682 . . . . 0.0 110.351 173.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -62.27 -40.23 95.53 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.602 0.564 . . . . 0.0 110.795 170.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.85 -24.07 63.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.322 0.649 . . . . 0.0 111.754 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.6 124.82 24.65 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 174.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -117.88 6.21 12.23 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.343 0.657 . . . . 0.0 109.324 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.7 p -145.38 143.44 30.11 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.893 0.877 . . . . 0.0 110.836 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.61 -32.09 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.646 172.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.72 -42.66 97.89 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.186 0.595 . . . . 0.0 111.633 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -27.79 63.63 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.502 0.321 . . . . 0.0 111.193 174.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -63.42 -38.65 91.96 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.346 0.258 . . . . 0.0 110.809 170.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -56.87 -58.44 8.14 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.399 0.679 . . . . 0.0 111.064 176.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -64.52 -29.7 70.73 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.826 0.704 . . . . 0.0 111.489 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.9 -56.71 10.39 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.517 0.511 . . . . 0.0 110.999 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.603 HG13 HG21 ' A' ' 75' ' ' VAL . 96.9 t -59.77 -48.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 O-C-N 123.73 0.644 . . . . 0.0 110.728 -177.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -65.22 -46.15 81.84 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.575 0.75 . . . . 0.0 112.869 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -65.06 -47.47 77.19 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.813 0.339 . . . . 0.0 110.41 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.48 -17.56 60.75 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.126 0.97 . . . . 0.0 111.968 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.518 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -80.79 -46.31 15.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.064 0.545 . . . . 0.0 109.91 176.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.1 -32.38 66.94 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.281 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.48 -158.01 0.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.765 1.226 . . . . 0.0 108.746 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 160.72 -60.8 0.3 Allowed Glycine 0 C--N 1.346 1.088 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.25 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 108.649 178.57 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.427 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.88 -163.53 52.07 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.613 0.571 . . . . 0.0 112.419 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.0 t -161.88 108.9 1.36 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.351 0.66 . . . . 0.0 109.659 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.5 t -80.71 121.28 25.69 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.733 0.813 . . . . 0.0 110.04 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -127.54 9.92 6.61 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.006 0.923 . . . . 0.0 109.729 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -83.17 132.65 35.07 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.816 0.847 . . . . 0.0 110.495 -169.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -162.61 178.1 8.84 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.068 0.947 . . . . 0.0 109.169 174.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -102.25 150.06 23.69 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.633 0.373 . . . . 0.0 110.372 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -142.4 41.78 1.62 Allowed 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 171.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -80.71 94.93 6.46 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.433 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -107.98 110.07 21.7 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.6 p -158.15 31.14 0.25 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.772 0.829 . . . . 0.0 109.894 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.65 79.7 0.81 Allowed Glycine 0 C--N 1.348 1.246 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.943 -173.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -97.38 106.69 19.05 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 170.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.95 91.44 5.42 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.314 0.578 . . . . 0.0 109.535 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -107.57 124.81 50.48 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.542 HD22 ' H ' ' A' ' 17' ' ' LEU . 1.1 pt? -65.5 90.75 0.11 Allowed 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 121.806 0.812 . . . . 0.0 111.559 -175.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -140.77 154.04 46.11 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.36 1.064 . . . . 0.0 109.356 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -94.15 116.94 29.41 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.289 0.635 . . . . 0.0 109.534 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -91.32 62.53 4.71 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 171.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.04 110.02 3.21 Favored Glycine 0 C--N 1.352 1.461 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.576 -176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -124.04 -179.77 4.54 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.456 1.102 . . . . 0.0 109.705 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.426 ' SD ' ' N ' ' A' ' 23' ' ' MET . 0.9 OUTLIER -65.32 129.29 94.37 Favored Pre-proline 0 N--CA 1.475 0.808 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.402 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.39 38.23 0.48 Allowed 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 123.805 3.003 . . . . 0.0 114.976 -172.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -74.88 96.83 3.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 162.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -108.26 -179.82 3.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.172 0.989 . . . . 0.0 108.464 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -80.56 -4.91 55.77 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.912 0.885 . . . . 0.0 111.93 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -47.02 -63.2 1.1 Allowed 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -168.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.4 -26.22 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.302 0.641 . . . . 0.0 111.159 -178.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 m170 -75.52 -35.81 60.67 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.08 0.952 . . . . 0.0 111.018 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -77.73 -34.31 52.62 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.37 -31.43 71.66 Favored 'General case' 0 CA--C 1.559 1.323 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.138 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 m -67.53 -41.81 83.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.645 0.778 . . . . 0.0 110.717 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.66 -43.75 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.496 0.719 . . . . 0.0 110.788 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.16 -33.53 76.22 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.495 0.718 . . . . 0.0 111.199 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.408 ' HA ' HD11 ' A' ' 46' ' ' ILE . 32.2 t -64.38 -36.98 85.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.353 0.661 . . . . 0.0 111.22 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.41 -48.73 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.827 176.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.515 ' HB3' HG13 ' A' ' 61' ' ' VAL . . . -67.12 -29.34 69.04 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.161 0.985 . . . . 0.0 112.398 -171.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 84.5 p -91.15 -52.61 4.74 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.123 0.569 . . . . 0.0 109.518 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.29 -10.44 28.78 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.761 -175.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.0 m -80.61 156.91 72.85 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.212 0.605 . . . . 0.0 110.071 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.401 ' HG2' ' HG3' ' A' ' 45' ' ' GLU . 35.1 Cg_endo -63.46 155.9 59.7 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.281 1.987 . . . . 0.0 112.546 172.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -60.27 -23.31 64.03 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.286 1.034 . . . . 0.0 112.077 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -63.53 -38.07 89.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.209 1.003 . . . . 0.0 111.713 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.401 ' HG3' ' HG2' ' A' ' 42' ' ' PRO . 39.2 mt-10 -87.1 -0.9 57.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.451 0.7 . . . . 0.0 112.347 -174.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.549 HG21 HD13 ' A' ' 55' ' ' LEU . 44.1 mt -98.36 137.86 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.166 0.586 . . . . 0.0 109.937 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 t -144.38 151.8 39.79 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.302 0.641 . . . . 0.0 109.367 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.433 ' HD2' ' N ' ' A' ' 49' ' ' ASP . 5.0 ppt_? -62.78 -30.99 71.88 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 123.765 0.666 . . . . 0.0 109.667 167.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.433 ' N ' ' HD2' ' A' ' 48' ' ' ARG . 34.5 t70 -83.42 80.22 9.16 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 123.55 0.74 . . . . 0.0 109.148 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.4 t -165.27 147.5 7.81 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.698 -177.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -85.82 27.27 0.88 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.292 0.637 . . . . 0.0 110.462 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.659 ' SD ' ' HB2' ' A' ' 56' ' ' ALA . 15.6 mmt 68.11 36.22 3.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.63 1.172 . . . . 0.0 110.023 -165.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -59.26 88.2 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.39 1.076 . . . . 0.0 111.726 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 64.91 11.33 6.91 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.164 1.385 . . . . 0.0 112.024 -178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.549 HD13 HG21 ' A' ' 46' ' ' ILE . 83.9 mt -97.02 -40.96 8.6 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.553 0.741 . . . . 0.0 110.925 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.659 ' HB2' ' SD ' ' A' ' 52' ' ' MET . . . -158.51 -167.15 2.08 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.839 0.856 . . . . 0.0 109.984 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.4 t80 81.84 -27.51 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 125.829 1.652 . . . . 0.0 112.098 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.7 136.49 56.87 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.584 0.754 . . . . 0.0 109.947 167.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.0 m -52.61 -44.0 65.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 112.967 -173.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.2 tp -69.73 -38.43 76.87 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.88 0.472 . . . . 0.0 110.818 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.515 HG13 ' HB3' ' A' ' 38' ' ' ALA . 49.1 t -66.86 -37.5 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.711 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.6 t -67.88 -34.38 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 123.343 0.657 . . . . 0.0 110.463 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.1 m -61.85 -49.43 76.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.198 0.599 . . . . 0.0 110.264 175.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -66.91 -37.71 84.86 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.107 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.04 -43.64 78.23 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.774 0.829 . . . . 0.0 110.398 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.2 t -65.48 -43.01 91.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.42 0.688 . . . . 0.0 110.839 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.64 -36.58 84.29 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.124 0.89 . . . . 0.0 110.55 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -70.54 -50.93 32.42 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.334 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.25 -38.38 83.3 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.613 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -59.0 -53.96 52.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.156 0.982 . . . . 0.0 112.17 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -84.91 -62.94 1.42 Allowed 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.818 0.342 . . . . 0.0 110.888 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -65.69 -47.76 74.36 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.008 0.923 . . . . 0.0 112.218 -166.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -91.2 -20.77 21.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.137 0.575 . . . . 0.0 111.813 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.55 0.57 89.38 Favored Glycine 0 C--N 1.352 1.429 0 N-CA-C 113.87 0.308 . . . . 0.0 113.87 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.88 108.82 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 124.286 1.034 . . . . 0.0 109.941 -177.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -133.27 166.47 22.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.155 0.582 . . . . 0.0 110.584 -176.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.29 18.02 79.76 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-N 116.334 -0.394 . . . . 0.0 112.475 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.9 m -110.42 15.79 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.484 1.114 . . . . 0.0 110.614 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.22 -45.24 88.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.709 1.204 . . . . 0.0 111.939 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -68.35 -36.47 79.28 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.694 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.95 -27.96 64.12 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.188 0.595 . . . . 0.0 111.199 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 99.3 mt -74.32 -26.88 60.43 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.51 0.724 . . . . 0.0 110.853 175.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.11 -37.31 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.184 171.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.86 16.35 3.4 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.096 0.958 . . . . 0.0 112.636 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.23 127.32 32.66 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.013 0.435 . . . . 0.0 111.231 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -93.07 -58.65 2.25 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.344 176.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.0 p -119.65 169.34 10.18 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.477 HG22 ' SD ' ' A' ' 52' ' ' MET . 47.6 t -70.07 -33.38 54.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.685 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.64 -40.01 90.38 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.031 0.933 . . . . 0.0 110.611 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -58.78 -43.13 90.33 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.357 1.063 . . . . 0.0 110.54 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 44.0 tp -61.37 -46.09 91.65 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.485 0.714 . . . . 0.0 111.945 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -58.73 -42.96 89.94 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 123.377 0.423 . . . . 0.0 111.081 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.28 -37.53 83.56 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.823 0.449 . . . . 0.0 111.481 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.51 -57.75 10.05 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.374 0.67 . . . . 0.0 110.903 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.15 -35.37 71.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.448 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.98 -45.04 90.82 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.206 1.002 . . . . 0.0 111.473 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -65.57 -41.3 93.09 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.807 -178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -79.97 -17.53 52.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.337 0.655 . . . . 0.0 111.975 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -72.22 -44.88 62.26 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.743 0.817 . . . . 0.0 109.453 174.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.29 -66.26 0.87 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.062 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.01 97.86 6.24 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.283 176.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 154.07 -53.58 0.45 Allowed Glycine 0 N--CA 1.461 0.319 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 CA--C 1.559 1.296 0 C-N-CA 125.089 1.355 . . . . 0.0 111.811 175.474 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.94 152.95 21.32 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 177.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m -75.24 101.11 4.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.511 0.724 . . . . 0.0 109.786 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.9 m -68.31 -50.6 52.36 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.604 0.762 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.8 m80 62.06 105.23 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.778 1.231 . . . . 0.0 111.663 -178.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -115.86 146.32 42.11 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.73 0.812 . . . . 0.0 111.644 -174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -148.99 42.77 0.96 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.724 1.209 . . . . 0.0 109.839 176.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.1 73.23 3.68 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 122.074 0.94 . . . . 0.0 111.813 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -94.0 142.08 27.8 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 109.165 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -159.4 140.13 12.43 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 124.117 0.967 . . . . 0.0 108.772 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.7 m -142.5 102.47 4.08 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.262 0.625 . . . . 0.0 109.729 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 m -140.34 99.75 3.73 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.431 1.093 . . . . 0.0 108.372 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -128.42 84.62 0.33 Allowed Glycine 0 C--N 1.34 0.795 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -176.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -147.33 132.34 18.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.37 0.668 . . . . 0.0 110.127 174.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -161.15 128.19 4.08 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 175.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 68.65 162.08 0.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 124.146 0.904 . . . . 0.0 110.799 -173.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 tt 70.97 97.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.891 1.276 . . . . 0.0 108.54 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -109.62 155.45 21.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.713 0.805 . . . . 0.0 109.425 -177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -72.8 -26.4 61.5 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 123.559 0.537 . . . . 0.0 110.689 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.467 ' HA ' ' HE2' ' A' ' 30' ' ' HIS . 83.6 mt-30 -82.1 -4.81 57.68 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.481 0.713 . . . . 0.0 111.601 175.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.32 -105.57 2.18 Favored Glycine 0 C--N 1.352 1.456 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -174.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -123.67 -61.76 1.36 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -102.31 115.64 64.21 Favored Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 173.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -60.94 176.22 1.04 Allowed 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.2 2.6 . . . . 0.0 113.508 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.72 86.86 0.12 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.674 1.589 . . . . 0.0 110.01 -173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -164.4 144.58 7.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.521 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -106.19 -36.95 6.73 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.604 0.761 . . . . 0.0 109.932 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -65.61 -62.97 1.21 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.391 0.677 . . . . 0.0 112.395 -166.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.85 -34.81 73.61 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.652 0.781 . . . . 0.0 110.85 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 20' ' ' GLN . 74.0 m80 -68.58 -35.55 77.53 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.466 0.706 . . . . 0.0 111.636 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.491 HD22 ' HG ' ' A' ' 91' ' ' LEU . 59.2 tp -71.7 -36.6 70.6 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 tp -61.76 -36.93 82.46 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.918 0.887 . . . . 0.0 110.623 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 m -70.43 -40.0 74.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.837 0.855 . . . . 0.0 110.405 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.6 t -60.56 -38.79 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.902 0.881 . . . . 0.0 110.538 176.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.527 HD23 HD21 ' A' ' 91' ' ' LEU . 95.9 mt -72.62 -33.95 67.01 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.753 0.821 . . . . 0.0 111.287 177.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.1 t -60.85 -38.09 84.34 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.468 0.48 . . . . 0.0 110.694 176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.3 t -79.61 -37.14 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.686 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.56 71.52 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 0.0 111.979 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m -88.7 -40.33 13.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.595 0.758 . . . . 0.0 110.471 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.36 -32.02 7.36 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.0 -175.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.5 m -73.84 143.63 81.6 Favored Pre-proline 0 CA--C 1.556 1.189 0 C-N-CA 123.583 0.753 . . . . 0.0 110.233 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.93 168.9 8.12 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.849 2.366 . . . . 0.0 113.532 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -63.39 -25.71 68.41 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.984 0.913 . . . . 0.0 112.149 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -69.07 -27.91 66.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.384 1.074 . . . . 0.0 110.854 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -76.83 -23.09 52.77 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.823 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.581 HG22 HD13 ' A' ' 55' ' ' LEU . 21.2 mt -109.0 144.24 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.749 0.819 . . . . 0.0 110.222 -173.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.7 t -156.07 170.8 21.35 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.012 1.325 . . . . 0.0 108.135 174.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -62.27 -32.66 73.4 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.97 0.508 . . . . 0.0 110.417 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -95.04 -1.65 51.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.421 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.3 m -71.74 -6.15 39.2 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.028 0.531 . . . . 0.0 112.339 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 72.4 mtp85 68.47 170.45 0.28 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.872 1.269 . . . . 0.0 112.638 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.76 ' HG3' ' HB2' ' A' ' 57' ' ' PHE . 44.7 tpp -112.63 90.88 3.46 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.181 -172.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 57' ' ' PHE . 10.3 tp10 -109.84 -68.73 0.9 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.139 0.976 . . . . 0.0 109.921 176.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -116.18 -18.47 10.57 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.95 0.9 . . . . 0.0 110.824 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.581 HD13 HG22 ' A' ' 46' ' ' ILE . 84.3 mt -60.95 -32.75 72.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.268 1.027 . . . . 0.0 112.842 -171.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.504 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . -163.37 13.96 0.06 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.393 0.677 . . . . 0.0 112.072 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.76 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 81.6 t80 -100.17 -32.22 11.01 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.538 0.335 . . . . 0.0 110.936 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -55.6 133.43 50.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.901 -0.571 . . . . 0.0 109.568 176.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.8 t -52.95 -37.86 61.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.371 1.069 . . . . 0.0 113.022 -170.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 53.1 tp -68.46 -43.98 75.83 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 123.48 0.488 . . . . 0.0 110.492 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.69 -28.53 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.4 t -67.34 -49.14 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.258 0.623 . . . . 0.0 110.241 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.9 m -63.59 -40.14 96.18 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 124.022 0.826 . . . . 0.0 110.718 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -67.14 -41.09 86.66 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.112 0.965 . . . . 0.0 111.051 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.504 HD22 ' HB2' ' A' ' 56' ' ' ALA . 35.0 tp -67.66 -48.87 65.44 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 123.453 0.47 . . . . 0.0 110.209 -175.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.0 t -64.22 -32.71 74.4 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.796 0.438 . . . . 0.0 110.742 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.5 -52.36 61.58 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.243 1.017 . . . . 0.0 109.955 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.1 OUTLIER -74.09 -42.67 59.77 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.572 -173.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 60.8 mt -61.43 -28.99 69.66 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.101 176.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -57.16 -32.09 66.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.232 1.013 . . . . 0.0 111.681 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HA ' ' HZ1' ' A' ' 71' ' ' LYS . 1.0 OUTLIER -97.14 -50.83 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.773 0.829 . . . . 0.0 111.046 177.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 25.4 mm-40 -62.28 -53.02 61.1 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.379 1.072 . . . . 0.0 112.226 -171.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -120.53 -4.36 9.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.219 0.607 . . . . 0.0 111.822 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.64 20.06 79.77 Favored Glycine 0 C--N 1.351 1.392 0 C-N-CA 123.364 0.507 . . . . 0.0 114.146 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 51.0 t -90.93 117.41 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.704 0.802 . . . . 0.0 109.532 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.8 m -145.41 150.25 36.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.008 0.923 . . . . 0.0 110.672 -171.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.41 15.8 78.96 Favored Glycine 0 C--N 1.359 1.825 0 O-C-N 123.555 0.534 . . . . 0.0 112.861 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.22 8.19 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.328 1.051 . . . . 0.0 111.055 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -54.0 -43.04 69.72 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 125.206 1.403 . . . . 0.0 112.29 -173.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.3 -43.77 96.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 113.765 -1.561 . . . . 0.0 110.051 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.44 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 30.5 tt0 -73.43 -28.89 62.22 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.721 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.442 HD23 HD12 ' A' ' 94' ' ' LEU . 93.0 mt -62.8 -37.97 88.82 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.077 0.951 . . . . 0.0 110.265 176.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.29 -39.03 75.1 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.036 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.78 -14.21 62.88 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.56 HD13 HD12 ' A' ' 94' ' ' LEU . 57.7 mt -70.82 123.2 21.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.887 0.475 . . . . 0.0 110.451 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.496 ' HG3' HG22 ' A' ' 87' ' ' THR . 10.7 pt-20 -93.12 -22.78 18.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.583 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 67.5 p -133.81 159.14 41.53 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.571 0.748 . . . . 0.0 111.122 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 t -69.22 -26.89 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.116 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' ' 93' ' ' GLN . 33.0 t70 -61.11 -43.91 98.16 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.191 0.596 . . . . 0.0 110.408 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.41 ' HB3' HD22 ' A' ' 85' ' ' LEU . 74.0 mm-40 -60.62 -32.38 71.52 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 123.882 0.739 . . . . 0.0 111.545 172.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.527 HD21 HD23 ' A' ' 35' ' ' LEU . 34.0 tp -67.83 -41.41 83.07 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 175.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -60.8 -40.37 92.42 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.956 0.408 . . . . 0.0 109.927 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 89' ' ' ASP . 76.7 mt-30 -64.1 -40.41 96.17 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.117 174.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.56 HD12 HD13 ' A' ' 85' ' ' LEU . 6.1 tt -59.64 -49.94 75.8 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.264 1.026 . . . . 0.0 110.907 -176.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.502 HG11 HG22 ' A' ' 75' ' ' VAL . 63.3 t -62.87 -50.81 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -65.11 -24.26 67.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 123.816 0.698 . . . . 0.0 112.435 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -67.33 -51.59 50.57 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.24 1.016 . . . . 0.0 109.854 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -82.49 -16.56 48.32 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.402 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -41.4 28.25 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.22 1.008 . . . . 0.0 109.33 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.35 -51.78 9.59 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.47 0.708 . . . . 0.0 110.677 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.54 97.66 9.7 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -150.4 37.3 0.91 Allowed Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.795 -0.522 . . . . 0.0 111.795 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.5 m . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 123.427 0.691 . . . . 0.0 109.505 178.568 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mtp . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.46 50.12 6.85 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 123.756 0.66 . . . . 0.0 113.703 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.6 m -69.44 98.91 1.16 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.474 0.709 . . . . 0.0 109.975 176.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.9 t -87.58 87.65 7.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.652 0.781 . . . . 0.0 109.657 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -123.51 74.11 1.23 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 175.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -134.36 24.07 3.78 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.04 0.936 . . . . 0.0 110.23 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -77.0 97.97 4.82 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.304 1.042 . . . . 0.0 110.373 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -123.09 127.87 49.33 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.54 1.136 . . . . 0.0 108.099 177.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.2 p-80 -69.47 110.03 4.54 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.498 0.666 . . . . 0.0 110.168 -179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -86.56 87.84 7.53 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.3 p -66.69 122.13 16.96 Favored 'General case' 0 C--N 1.352 0.675 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.081 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.2 m -106.8 151.23 25.46 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 123.63 0.772 . . . . 0.0 109.97 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.92 77.54 1.3 Allowed Glycine 0 C--N 1.348 1.23 0 O-C-N 123.808 0.692 . . . . 0.0 111.789 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.642 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 19.2 mmt180 -121.26 103.83 9.28 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.506 1.123 . . . . 0.0 109.703 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -64.24 99.68 0.29 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 0.0 111.231 -177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 65.02 10.65 6.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.615 1.166 . . . . 0.0 112.839 175.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.642 ' HB2' ' HB3' ' A' ' 14' ' ' ARG . 88.3 mt -93.18 57.29 2.68 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.719 0.771 . . . . 0.0 109.351 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -150.47 69.11 0.98 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.353 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -68.75 -39.5 80.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.397 -1.274 . . . . 0.0 109.954 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -142.95 139.43 30.69 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.086 0.554 . . . . 0.0 110.008 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.7 -78.9 0.17 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -167.22 124.3 1.2 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.438 1.095 . . . . 0.0 108.877 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -86.61 144.92 38.25 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -52.5 128.03 26.39 Favored 'Trans proline' 0 C--N 1.38 2.225 0 C-N-CA 123.202 2.601 . . . . 0.0 112.94 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.4 ' H ' HD21 ' A' ' 25' ' ' ASN . 0.1 OUTLIER -103.09 23.3 12.55 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.313 0.645 . . . . 0.0 110.445 178.131 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.25 167.55 17.56 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.497 1.119 . . . . 0.0 110.921 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.0 ptm -60.65 -28.38 68.52 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.007 0.923 . . . . 0.0 111.767 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.422 ' HA ' ' HE1' ' A' ' 92' ' ' PHE . 51.3 mt-10 -59.93 -53.03 62.69 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 123.347 0.659 . . . . 0.0 110.492 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.83 -34.79 78.97 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.241 -179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -64.11 -38.26 90.43 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.409 0.683 . . . . 0.0 111.867 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.47 HD23 HG21 ' A' ' 95' ' ' VAL . 58.3 mt -69.16 -38.55 78.79 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.175 0.512 . . . . 0.0 111.016 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tp -67.86 -37.39 81.77 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.952 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.6 m -76.13 -37.51 57.93 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.653 1.181 . . . . 0.0 110.936 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.406 HG11 ' HA ' ' A' ' 31' ' ' LEU . 11.7 p -68.96 -35.4 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 117.78 0.264 . . . . 0.0 110.614 -176.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.64 -39.74 84.6 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.543 173.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.1 t -59.65 -51.73 68.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.678 0.791 . . . . 0.0 111.733 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.4 t -71.04 -45.8 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 123.958 0.903 . . . . 0.0 111.335 -174.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.32 80.48 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.045 0.538 . . . . 0.0 111.627 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.6 m -85.93 -15.89 40.21 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.933 0.493 . . . . 0.0 111.666 178.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.02 6.73 89.02 Favored Glycine 0 C--N 1.352 1.468 0 C-N-CA 122.739 0.209 . . . . 0.0 113.495 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.704 HG22 HD21 ' A' ' 55' ' ' LEU . 27.1 m -88.44 161.52 42.37 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 124.923 1.289 . . . . 0.0 111.003 -178.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.23 149.03 92.11 Favored 'Trans proline' 0 C--N 1.367 1.529 0 C-N-CA 122.416 2.077 . . . . 0.0 111.36 162.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -70.04 -19.26 63.31 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.239 0.616 . . . . 0.0 110.53 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.37 -27.46 64.25 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.132 0.973 . . . . 0.0 112.65 172.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.83 -16.85 61.6 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.89 0.876 . . . . 0.0 111.454 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.13 125.19 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.666 0.786 . . . . 0.0 111.081 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.3 t -125.8 177.11 6.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.438 1.095 . . . . 0.0 108.066 168.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -68.52 -39.08 81.34 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 122.559 0.344 . . . . 0.0 110.982 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.36 -3.68 58.44 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.8 0.84 . . . . 0.0 112.025 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -72.36 164.69 25.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.229 0.612 . . . . 0.0 111.986 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.646 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 0.0 OUTLIER -110.38 132.39 54.22 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.377 0.608 . . . . 0.0 110.361 173.355 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 24.9 ptp -80.68 67.71 6.65 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 122.339 1.066 . . . . 0.0 109.104 171.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -86.14 -70.77 0.58 Allowed 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.54 -30.99 67.88 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 172.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.704 HD21 HG22 ' A' ' 41' ' ' VAL . 2.7 mp -91.07 140.52 29.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.592 1.157 . . . . 0.0 108.965 -173.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 74.61 -37.32 0.35 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 170.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -63.53 -29.35 70.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.673 1.189 . . . . 0.0 113.726 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.11 135.88 48.75 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.491 0.717 . . . . 0.0 110.7 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 m -60.84 -33.08 72.5 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -171.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.17 -37.83 75.28 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.193 0.597 . . . . 0.0 109.964 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -72.57 -38.03 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.839 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.5 t -65.19 -34.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 C-N-CA 123.807 0.843 . . . . 0.0 110.328 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.4 t -62.68 -49.13 76.31 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.288 0.635 . . . . 0.0 109.82 178.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 9.1 tp10 -67.33 -41.88 84.53 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.172 0.589 . . . . 0.0 110.513 178.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.56 -44.46 96.99 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.678 1.191 . . . . 0.0 111.147 -177.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.6 p -65.79 -36.17 82.76 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.667 0.787 . . . . 0.0 110.991 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 96.9 mt -63.92 -40.6 96.85 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.913 0.758 . . . . 0.0 111.097 173.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 75.1 mmtt -67.58 -44.04 79.11 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.002 0.521 . . . . 0.0 111.076 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.5 mt -67.32 -35.68 79.91 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.582 0.353 . . . . 0.0 110.172 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -60.69 -39.37 88.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.958 1.303 . . . . 0.0 111.419 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' LEU . 74.2 mmtt -91.64 -68.06 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.926 0.49 . . . . 0.0 110.773 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -63.0 -42.66 99.91 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.249 1.02 . . . . 0.0 112.472 -169.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -98.08 -20.98 17.03 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.147 0.579 . . . . 0.0 111.041 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.89 -7.92 68.42 Favored Glycine 0 C--N 1.353 1.515 0 CA-C-O 119.893 -0.393 . . . . 0.0 113.16 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.469 HG21 HG11 ' A' ' 95' ' ' VAL . 68.9 t -75.75 98.4 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 124.534 1.133 . . . . 0.0 110.021 -175.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.7 m -109.17 154.86 21.76 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.485 1.114 . . . . 0.0 110.271 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.37 20.32 72.32 Favored Glycine 0 C--N 1.351 1.409 0 C-N-CA 123.251 0.453 . . . . 0.0 113.392 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 m -108.96 16.08 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.639 0.776 . . . . 0.0 110.982 -177.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.48 -56.89 14.96 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.099 1.359 . . . . 0.0 111.292 -175.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.33 -34.97 79.38 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.679 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -68.09 -30.69 69.92 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.636 0.775 . . . . 0.0 110.528 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 96.6 mt -70.4 -39.69 74.34 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.081 0.952 . . . . 0.0 110.96 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.62 -35.41 76.1 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.852 173.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.92 -19.99 53.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.5 0.72 . . . . 0.0 112.19 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.521 HD13 HD11 ' A' ' 94' ' ' LEU . 69.8 mt -67.88 138.65 56.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 117.95 0.341 . . . . 0.0 111.398 176.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -119.54 -38.07 3.05 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 123.364 0.665 . . . . 0.0 109.601 177.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.646 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 50.8 p -108.19 148.06 30.46 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 122.119 0.961 . . . . 0.0 112.164 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.427 HG11 ' CE2' ' A' ' 92' ' ' PHE . 34.0 t -65.71 -30.11 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 113.987 -1.46 . . . . 0.0 109.834 176.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.4 -46.49 80.15 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.067 0.947 . . . . 0.0 111.169 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.02 -32.99 74.73 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.264 176.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.98 -48.64 79.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 123.639 0.587 . . . . 0.0 111.902 174.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CE2' HG11 ' A' ' 88' ' ' VAL . 64.3 m-85 -56.29 -45.09 80.33 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.235 0.614 . . . . 0.0 110.902 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.543 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 48.6 mt-30 -64.52 -49.24 72.07 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.944 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.521 HD11 HD13 ' A' ' 85' ' ' LEU . 8.5 tt -51.72 -57.85 8.08 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.053 1.341 . . . . 0.0 110.378 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.47 HG21 HD23 ' A' ' 31' ' ' LEU . 70.8 t -58.84 -38.75 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.657 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.5 -36.25 78.64 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.17 0.588 . . . . 0.0 111.906 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 34.3 mmtp -66.49 -39.26 88.64 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.214 0.606 . . . . 0.0 110.127 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.456 ' HA ' ' HA3' ' A' ' 102' ' ' GLY . 86.8 m-70 -78.62 -24.69 45.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.134 0.574 . . . . 0.0 111.208 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -77.62 -32.31 53.37 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.362 0.665 . . . . 0.0 110.64 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.56 -62.12 1.32 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.674 0.79 . . . . 0.0 111.105 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -103.43 -9.4 19.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.638 -171.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 98' ' ' HIS . . . -100.12 46.17 1.41 Allowed Glycine 0 N--CA 1.474 1.23 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 -176.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--O 1.249 1.034 0 C-N-CA 123.842 0.857 . . . . 0.0 110.383 179.489 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 ttm . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.98 -127.67 9.3 Favored Glycine 0 C--N 1.348 1.243 0 N-CA-C 111.96 -0.456 . . . . 0.0 111.96 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.5 m -136.75 100.15 4.24 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.922 0.889 . . . . 0.0 109.751 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 58.6 p -80.13 114.51 19.09 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 174.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.2 m80 -86.52 -86.91 0.14 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 59.93 20.28 9.28 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.416 1.086 . . . . 0.0 113.44 169.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -110.8 173.42 6.34 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.579 0.751 . . . . 0.0 110.456 -177.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -148.66 131.73 16.3 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 108.433 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -85.66 -19.9 30.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.016 0.526 . . . . 0.0 111.401 -176.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 59.74 86.74 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.509 1.124 . . . . 0.0 110.579 -176.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.1 p -79.04 74.33 5.58 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.409 0.684 . . . . 0.0 110.593 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.6 t -176.4 161.82 2.27 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.975 1.31 . . . . 0.0 108.849 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.73 -72.53 0.13 Allowed Glycine 0 C--N 1.339 0.702 0 N-CA-C 111.879 -0.488 . . . . 0.0 111.879 177.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -131.05 155.75 46.36 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.484 0.714 . . . . 0.0 111.019 -174.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -158.77 88.52 0.91 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.225 1.01 . . . . 0.0 109.516 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -71.53 -56.46 5.85 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 66.2 tp -123.91 -40.61 2.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 172.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 18.2 t80 67.16 21.26 10.09 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.848 1.259 . . . . 0.0 110.602 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 62.38 25.19 15.03 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.938 1.295 . . . . 0.0 111.59 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.87 98.45 9.18 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 123.323 0.649 . . . . 0.0 109.521 -177.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.04 -102.05 1.4 Allowed Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.068 175.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -145.57 168.83 19.69 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.925 0.89 . . . . 0.0 110.827 -176.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 59.9 mtm -84.82 151.77 58.47 Favored Pre-proline 0 CA--C 1.549 0.935 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.23 173.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.19 85.11 0.26 Allowed 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 122.395 2.063 . . . . 0.0 111.531 174.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.38 93.24 9.46 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.051 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -166.1 143.13 5.24 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.161 0.584 . . . . 0.0 111.404 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 tmm? 40.63 -80.08 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 127.252 2.221 . . . . 0.0 113.151 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' HD23 ' A' ' 32' ' ' LEU . 35.5 mt-10 -53.82 -48.63 69.72 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 123.941 0.896 . . . . 0.0 111.122 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.06 -47.05 78.67 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.159 0.912 . . . . 0.0 111.28 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.435 ' O ' HG21 ' A' ' 34' ' ' VAL . 55.4 t60 -73.19 -25.95 60.98 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.619 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.46 -40.02 85.33 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 0.9 OUTLIER -60.89 -40.48 93.22 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.513 0.325 . . . . 0.0 110.202 171.435 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -63.59 -37.99 89.41 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.556 0.742 . . . . 0.0 110.978 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 30' ' ' HIS . 61.1 t -62.61 -50.75 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 122.801 0.441 . . . . 0.0 109.852 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.74 -42.33 95.27 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 122.697 0.399 . . . . 0.0 111.593 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.2 p -64.69 -39.6 93.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.563 0.745 . . . . 0.0 111.96 -174.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.56 -31.33 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.293 175.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.97 -7.71 59.04 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 0.0 112.509 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -112.31 -61.54 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.426 0.69 . . . . 0.0 109.987 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.12 -34.42 2.26 Favored Glycine 0 C--N 1.341 0.84 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.292 -173.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.19 154.87 92.08 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 123.19 0.596 . . . . 0.0 111.1 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -55.23 152.57 30.75 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 123.008 2.472 . . . . 0.0 113.27 168.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.579 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 21.4 ptmt -69.71 -22.81 63.37 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.599 0.76 . . . . 0.0 111.817 -179.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -73.21 -25.4 60.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.336 0.654 . . . . 0.0 110.505 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -72.95 -18.58 61.37 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.446 0.698 . . . . 0.0 111.593 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.0 mt -102.19 124.23 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.312 0.645 . . . . 0.0 109.704 -177.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -133.42 -179.88 5.79 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.297 1.039 . . . . 0.0 108.723 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.504 ' HB3' ' HB2' ' A' ' 89' ' ' ASP . 5.5 mpt_? -58.85 -55.12 39.2 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.004 0.922 . . . . 0.0 111.585 -172.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -90.47 3.92 52.53 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 0.0 112.343 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.5 m -74.48 -0.76 18.55 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.602 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 49.7 mtt180 66.81 170.74 0.25 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 112.259 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.714 ' SD ' HD21 ' A' ' 91' ' ' LEU . 72.5 mtm -116.45 29.54 7.89 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.231 1.013 . . . . 0.0 108.973 168.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.98 -55.83 30.11 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.207 0.942 . . . . 0.0 110.795 -172.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -101.72 16.21 26.53 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.972 0.909 . . . . 0.0 110.568 177.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 74.4 mt -114.34 -68.14 0.95 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.842 0.457 . . . . 0.0 111.615 -171.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -112.24 -21.4 11.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -173.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -70.6 89.65 0.73 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.162 0.585 . . . . 0.0 110.32 -176.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -177.62 146.97 0.48 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.616 1.566 . . . . 0.0 108.213 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -56.49 -46.6 80.41 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.386 0.674 . . . . 0.0 112.049 -177.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.41 -37.84 63.24 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.022 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.19 -32.8 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.218 0.324 . . . . 0.0 111.736 -175.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.5 -37.42 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 171.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 70.7 m -67.25 -37.28 83.24 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.013 0.525 . . . . 0.0 111.272 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.43 -37.2 65.94 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.7 tp -66.68 -48.11 70.34 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.472 ' HB3' HD13 ' A' ' 82' ' ' LEU . 40.8 p -66.62 -33.23 75.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.216 0.607 . . . . 0.0 111.665 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 56.2 tp -69.31 -40.4 77.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.348 0.659 . . . . 0.0 110.516 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -71.99 -42.09 66.87 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.392 0.677 . . . . 0.0 110.39 -177.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.451 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 93.3 mt -66.57 -38.55 87.31 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.052 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -55.27 -45.08 76.16 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.582 1.153 . . . . 0.0 111.516 177.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.7 -66.51 0.69 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.762 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.94 -54.49 6.5 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.043 -165.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -89.5 -11.68 42.23 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.454 -174.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.57 -7.6 53.03 Favored Glycine 0 C--N 1.355 1.612 0 C-N-CA 123.836 0.731 . . . . 0.0 114.393 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.451 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 48.5 t -77.56 102.79 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.84 0.856 . . . . 0.0 110.777 -171.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 t -137.32 169.36 17.92 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.695 0.798 . . . . 0.0 110.313 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.01 14.62 78.7 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.538 -176.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.422 HG22 HG12 ' A' ' 75' ' ' VAL . 35.7 m -119.91 16.17 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.429 1.092 . . . . 0.0 111.274 -173.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -54.94 -44.76 74.58 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.04 0.936 . . . . 0.0 112.216 -173.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -67.07 -34.09 76.92 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.458 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.465 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.3 mp0 -67.43 -38.5 84.66 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.668 0.605 . . . . 0.0 110.381 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 66' ' ' SER . 97.7 mt -63.91 -31.47 72.66 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.333 0.653 . . . . 0.0 111.197 178.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -75.1 -35.02 61.8 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.512 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -69.84 -23.46 63.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.631 0.772 . . . . 0.0 111.384 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.551 HD12 HD13 ' A' ' 94' ' ' LEU . 95.1 mt -76.31 118.11 18.68 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 122.938 0.495 . . . . 0.0 110.475 178.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.87 -13.76 19.92 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.682 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.602 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -137.55 144.09 41.91 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 124.086 0.954 . . . . 0.0 111.477 -168.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.7 t -75.23 -23.66 17.2 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.06 -171.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.504 ' HB2' ' HB3' ' A' ' 48' ' ' ARG . 31.7 t70 -59.62 -50.06 75.36 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.452 0.644 . . . . 0.0 110.239 178.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -68.02 -31.56 71.32 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.319 -1.31 . . . . 0.0 110.556 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.714 HD21 ' SD ' ' A' ' 52' ' ' MET . 52.5 tp -64.33 -47.29 79.92 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 123.406 0.441 . . . . 0.0 111.586 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -56.73 -45.96 81.64 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.599 0.76 . . . . 0.0 109.881 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.78 -34.06 74.92 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.863 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.551 HD13 HD12 ' A' ' 85' ' ' LEU . 9.4 tt -70.32 -47.03 62.96 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.62 -48.69 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 123.42 0.688 . . . . 0.0 110.057 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.71 -36.34 80.45 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.602 0.761 . . . . 0.0 111.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -64.43 -48.65 74.54 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.306 0.642 . . . . 0.0 110.5 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -77.37 -18.45 57.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.695 0.798 . . . . 0.0 111.499 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -78.44 -46.46 19.73 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.482 0.713 . . . . 0.0 110.282 176.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.51 -62.27 1.58 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.36 0.664 . . . . 0.0 109.901 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -81.6 78.32 8.35 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.907 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -118.88 19.77 10.17 Favored Glycine 0 C--N 1.343 0.92 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.359 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 23.8 p . . . . . 0 CA--C 1.556 1.208 0 C-N-CA 123.973 0.909 . . . . 0.0 110.349 -179.572 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 mtm . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.85 -159.33 20.85 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 111.436 -0.665 . . . . 0.0 111.436 -174.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p 51.34 78.87 0.1 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.18 1.392 . . . . 0.0 112.219 -175.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.7 p -73.76 97.32 2.69 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.283 176.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.5 p80 -62.46 -34.98 77.88 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.287 0.635 . . . . 0.0 110.849 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.6 t70 65.67 157.86 0.1 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.558 1.543 . . . . 0.0 111.456 -178.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.608 ' HE1' HG11 ' A' ' 37' ' ' VAL . 11.5 t-80 -72.82 -58.65 3.18 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 122.973 0.509 . . . . 0.0 110.129 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 54.59 83.2 0.08 Allowed 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.63 1.172 . . . . 0.0 113.564 170.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -117.66 123.71 46.79 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 172.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -113.67 74.48 0.87 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 174.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -86.59 83.21 7.66 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.387 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.6 p -140.09 165.14 28.16 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.734 0.814 . . . . 0.0 110.031 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.96 -109.33 0.89 Allowed Glycine 0 C--N 1.342 0.881 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -88.25 88.86 7.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.169 0.588 . . . . 0.0 109.841 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.7 142.39 27.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.916 0.887 . . . . 0.0 109.414 176.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -109.18 144.5 37.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.172 0.589 . . . . 0.0 110.576 -176.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.98 164.49 26.56 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.753 0.821 . . . . 0.0 111.08 176.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -90.54 171.4 9.43 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.933 0.893 . . . . 0.0 110.665 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -98.87 -44.79 6.22 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.866 0.866 . . . . 0.0 109.104 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -139.26 145.21 38.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.048 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.17 -74.74 0.25 Allowed Glycine 0 C--N 1.344 1.005 0 N-CA-C 111.504 -0.639 . . . . 0.0 111.504 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 63.3 14.06 7.52 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.012 1.325 . . . . 0.0 112.063 -175.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.6 ttt -162.59 80.66 1.74 Allowed Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.25 1.02 . . . . 0.0 108.418 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -85.46 -179.36 3.42 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.378 2.052 . . . . 0.0 111.539 173.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.2 t30 66.42 6.45 4.34 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.805 1.242 . . . . 0.0 112.015 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -92.26 147.66 22.75 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 118.111 -0.947 . . . . 0.0 109.124 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.499 ' HE2' HG13 ' A' ' 95' ' ' VAL . 20.1 ttt -18.9 -60.04 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 C-N-CA 127.427 2.291 . . . . 0.0 116.324 -169.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.87 -58.73 6.39 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.121 0.568 . . . . 0.0 110.555 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -62.09 -31.55 72.01 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.17 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.403 ' O ' HG22 ' A' ' 34' ' ' VAL . 5.1 t60 -71.91 -31.68 66.63 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.63 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.3 -37.56 85.69 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.896 0.478 . . . . 0.0 109.713 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -65.09 -35.9 82.61 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.751 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.5 m -66.53 -41.66 88.44 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.238 0.615 . . . . 0.0 110.069 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 30' ' ' HIS . 43.9 t -58.76 -47.04 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.069 0.948 . . . . 0.0 110.294 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.526 ' HB3' HD22 ' A' ' 55' ' ' LEU . 98.2 mt -68.35 -37.69 80.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.342 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.7 t -64.6 -39.52 93.87 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.085 0.954 . . . . 0.0 111.253 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.608 HG11 ' HE1' ' A' ' 7' ' ' HIS . 65.7 t -78.7 -30.54 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.379 0.672 . . . . 0.0 110.201 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.93 -25.95 53.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.316 0.646 . . . . 0.0 112.156 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.5 p -108.26 -66.11 1.07 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.002 0.521 . . . . 0.0 110.151 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.06 -27.04 2.81 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-O 119.847 -0.418 . . . . 0.0 112.163 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.05 131.66 88.85 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.967 0.507 . . . . 0.0 110.813 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.66 158.82 26.53 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 123.304 2.669 . . . . 0.0 112.478 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -63.12 -21.1 65.96 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.719 0.808 . . . . 0.0 112.51 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -65.83 -26.16 67.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.765 0.826 . . . . 0.0 111.335 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -100.29 8.27 43.84 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.885 0.874 . . . . 0.0 111.914 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.487 HG12 HD21 ' A' ' 55' ' ' LEU . 38.4 mt -113.14 140.08 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.188 0.595 . . . . 0.0 109.876 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -151.55 173.33 14.75 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.517 1.127 . . . . 0.0 109.366 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -30.25 69.92 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.463 0.649 . . . . 0.0 110.0 169.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.39 15.58 10.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.526 1.13 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.503 ' HB3' HG21 ' A' ' 88' ' ' VAL . 47.9 t -70.22 -21.38 63.02 Favored 'General case' 0 C--N 1.358 0.976 0 O-C-N 122.052 -0.405 . . . . 0.0 110.452 171.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 56.45 23.18 7.19 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.834 1.253 . . . . 0.0 113.404 169.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.6 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 14.3 mmt 60.4 54.58 3.82 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.195 0.998 . . . . 0.0 111.928 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 50' ' ' SER . 20.0 mm-40 -68.8 -71.31 0.22 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.179 0.514 . . . . 0.0 110.208 177.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.03 -19.99 14.01 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.915 1.286 . . . . 0.0 109.837 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 35' ' ' LEU . 4.4 mp -93.15 133.12 36.65 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.21 1.004 . . . . 0.0 110.357 -168.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.6 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 68.38 -69.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.861 1.664 . . . . 0.0 112.051 176.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.548 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 43.9 t80 -56.79 90.84 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.342 1.457 . . . . 0.0 111.776 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.1 t70 176.14 146.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 106.513 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 56.2 p -56.84 -45.48 82.34 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.054 0.542 . . . . 0.0 112.271 -175.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.6 tp -70.37 -49.08 52.92 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.279 0.632 . . . . 0.0 110.867 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 18.5 t -71.53 -26.45 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 123.43 0.457 . . . . 0.0 111.322 -172.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.91 -43.96 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.506 0.722 . . . . 0.0 109.646 172.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.1 m -62.27 -36.5 82.25 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.468 0.651 . . . . 0.0 111.122 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.545 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 25.6 tt0 -75.22 -37.84 60.93 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.306 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 35.1 tp -65.47 -28.45 69.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.319 0.648 . . . . 0.0 110.673 176.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 58.2 m -63.07 -49.48 74.36 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.097 0.959 . . . . 0.0 110.553 175.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -75.19 -19.94 59.56 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 119.217 -0.421 . . . . 0.0 112.126 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 72.9 mmtt -64.43 -62.88 1.32 Allowed 'General case' 0 C--N 1.367 1.365 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.63 -30.46 69.88 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.524 1.129 . . . . 0.0 111.802 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -52.9 -49.24 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.913 1.285 . . . . 0.0 110.451 173.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -91.42 -24.5 19.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.52 0.728 . . . . 0.0 111.722 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -85.64 -52.98 5.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.821 0.848 . . . . 0.0 111.571 -166.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -117.58 -2.19 11.52 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.365 0.666 . . . . 0.0 110.848 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.5 -3.88 83.56 Favored Glycine 0 C--N 1.353 1.515 0 C-N-CA 122.992 0.329 . . . . 0.0 113.409 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.0 t -89.36 98.44 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.8 t -80.17 143.66 33.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.177 0.591 . . . . 0.0 112.336 -169.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.32 -87.22 0.5 Allowed Glycine 0 C--N 1.351 1.377 0 O-C-N 124.287 0.992 . . . . 0.0 112.872 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.571 HG13 ' HB3' ' A' ' 81' ' ' GLU . 3.5 t 62.3 21.93 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 C-N-CA 124.518 1.127 . . . . 0.0 110.032 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.07 -41.22 74.77 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.814 1.246 . . . . 0.0 112.663 -168.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -62.08 -44.87 95.73 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 123.875 0.734 . . . . 0.0 111.009 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.571 ' HB3' HG13 ' A' ' 78' ' ' VAL . 8.4 tp10 -72.61 -47.88 44.15 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.186 -175.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.87 -30.61 70.98 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.971 0.908 . . . . 0.0 111.475 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.76 -44.89 80.21 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.508 0.723 . . . . 0.0 110.476 171.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -71.57 -27.75 63.37 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.901 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 80.0 mt -66.67 111.98 3.95 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.384 0.611 . . . . 0.0 110.791 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -100.52 -22.07 15.12 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.285 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.96 149.22 50.43 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.377 0.671 . . . . 0.0 111.286 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.503 HG21 ' HB3' ' A' ' 50' ' ' SER . 45.0 t -66.0 -28.42 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.218 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 17.7 t70 -60.04 -41.46 92.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 122.761 0.424 . . . . 0.0 110.559 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.44 -29.9 69.49 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.23 0.612 . . . . 0.0 111.625 175.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.409 HD23 ' HE3' ' A' ' 52' ' ' MET . 69.3 tp -64.74 -39.37 93.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.557 0.343 . . . . 0.0 110.623 171.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.72 -41.07 98.14 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.773 0.429 . . . . 0.0 110.522 174.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 73.6 mm-40 -62.45 -42.13 99.24 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.817 0.447 . . . . 0.0 110.509 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.553 HD12 ' HG2' ' A' ' 81' ' ' GLU . 42.3 tp -59.65 -61.01 2.94 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.057 0.943 . . . . 0.0 110.897 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.499 HG13 ' HE2' ' A' ' 27' ' ' MET . 87.7 t -64.44 -40.75 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.151 0.581 . . . . 0.0 111.099 -172.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.472 ' HA ' ' HE1' ' A' ' 27' ' ' MET . 1.2 tm-20 -68.02 -53.57 24.91 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.52 0.728 . . . . 0.0 110.246 -176.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -66.51 -36.07 81.8 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.396 0.678 . . . . 0.0 111.707 -174.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 -84.7 -22.53 29.73 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.45 ' NH1' ' SD ' ' A' ' 27' ' ' MET . 46.5 ttt180 -74.62 -37.85 62.71 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.46 -51.88 52.1 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.791 0.837 . . . . 0.0 110.244 172.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 67.23 -69.77 0.13 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.464 1.906 . . . . 0.0 112.118 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 87.93 14.72 62.33 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 111.782 -0.527 . . . . 0.0 111.782 -174.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--O 1.249 1.039 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -176.338 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.9 mtm . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.28 146.67 11.68 Favored Glycine 0 C--N 1.345 1.083 0 N-CA-C 112.193 -0.363 . . . . 0.0 112.193 -177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 p -162.46 106.72 1.15 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.406 1.083 . . . . 0.0 108.985 176.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.9 m -120.6 26.17 9.31 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.029 0.932 . . . . 0.0 111.058 -178.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -70.93 101.09 2.08 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -154.52 151.78 29.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.364 1.066 . . . . 0.0 109.381 -174.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -126.46 149.37 49.35 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.969 0.908 . . . . 0.0 110.326 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -75.99 137.53 40.34 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.672 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -92.72 132.58 36.81 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -70.73 111.09 5.92 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.364 0.665 . . . . 0.0 111.139 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -79.99 142.83 34.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.865 0.866 . . . . 0.0 110.131 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.8 p -150.74 131.68 14.23 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.716 0.806 . . . . 0.0 110.222 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.35 73.74 0.25 Allowed Glycine 0 C--N 1.345 1.074 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 177.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -78.99 74.74 5.51 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.027 0.931 . . . . 0.0 109.099 -179.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -88.86 -25.55 22.1 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.128 -174.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -125.49 168.25 13.89 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.447 1.099 . . . . 0.0 110.608 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.33 89.51 6.09 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -66.02 106.26 1.55 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.428 -178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -156.04 141.05 17.31 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.079 0.552 . . . . 0.0 110.481 -175.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -151.44 170.2 20.17 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.749 1.22 . . . . 0.0 108.775 172.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.33 -59.34 2.57 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 177.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 56.46 -100.41 0.11 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 124.905 1.282 . . . . 0.0 110.497 -177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -147.57 163.17 28.99 Favored Pre-proline 0 N--CA 1.48 1.062 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.83 170.93 1.75 Allowed 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.918 1.745 . . . . 0.0 113.205 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.413 ' N ' HD21 ' A' ' 25' ' ' ASN . 0.7 OUTLIER 80.25 -98.57 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.437 1.895 . . . . 0.0 110.962 -177.595 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 51.99 -82.59 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 0.0 112.404 -172.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.5 tmm? -143.07 -51.57 0.36 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.927 0.891 . . . . 0.0 108.929 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.19 -61.83 2.1 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 124.054 0.846 . . . . 0.0 111.721 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.561 ' HA ' HD21 ' A' ' 32' ' ' LEU . 30.5 t70 -69.85 -24.69 63.48 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.881 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -65.77 -33.45 75.9 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.429 0.692 . . . . 0.0 110.477 170.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.433 HD21 HD21 ' A' ' 91' ' ' LEU . 10.4 tt -68.8 -37.05 78.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.071 0.548 . . . . 0.0 110.079 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' A' ' 29' ' ' ASP . 2.6 mm? -62.77 -34.98 78.38 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 123.03 0.206 . . . . 0.0 111.144 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -63.22 -42.22 99.24 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.457 0.703 . . . . 0.0 110.609 176.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.495 HG12 ' HG2' ' A' ' 68' ' ' LYS . 41.4 t -63.82 -43.07 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.38 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.02 -39.44 93.4 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.049 0.54 . . . . 0.0 111.484 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.5 p -68.15 -31.56 71.22 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.484 0.49 . . . . 0.0 111.682 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.8 t -75.04 -39.87 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.058 0 C-N-CA 122.876 0.47 . . . . 0.0 110.155 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.58 -29.94 62.71 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.649 0.78 . . . . 0.0 112.244 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.6 p -94.42 -53.78 3.78 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.192 0.597 . . . . 0.0 110.147 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.55 -15.04 9.89 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.951 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.8 m -92.67 145.72 30.9 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.363 0.665 . . . . 0.0 110.523 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -51.25 158.16 3.83 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.836 3.024 . . . . 0.0 115.162 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -63.35 -22.83 67.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.473 1.109 . . . . 0.0 111.984 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.42 -29.21 68.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.785 0.434 . . . . 0.0 111.147 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.62 0.56 56.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.601 0.761 . . . . 0.0 111.0 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.44 HG21 HD11 ' A' ' 32' ' ' LEU . 34.9 mt -129.82 105.96 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 123.674 0.789 . . . . 0.0 110.751 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.8 t -110.72 -177.77 3.31 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.737 0.815 . . . . 0.0 109.172 170.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.9 ptp85 -67.11 -33.36 75.3 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 173.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -70.43 -19.48 62.98 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.235 1.014 . . . . 0.0 111.3 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 m -66.44 149.23 50.73 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.873 0.844 . . . . 0.0 111.499 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.543 ' HD3' HG22 ' A' ' 87' ' ' THR . 16.4 mmt180 -82.98 -161.45 0.49 Allowed 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.183 178.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 49.5 mtt -130.99 -2.61 4.04 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.94 -10.92 23.98 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 118.833 0.742 . . . . 0.0 112.698 -173.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -141.88 26.57 1.88 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.746 0.818 . . . . 0.0 109.675 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 72.5 mt -136.35 -32.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.701 0.8 . . . . 0.0 112.616 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.51 -41.32 0.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 122.797 0.439 . . . . 0.0 112.0 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -61.28 87.78 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.925 1.29 . . . . 0.0 111.242 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 175.38 133.12 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.238 1.815 . . . . 0.0 106.307 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.3 m -52.29 -38.22 57.75 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 119.026 0.83 . . . . 0.0 113.17 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.04 -41.23 62.12 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.472 0.709 . . . . 0.0 111.141 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.9 t -76.98 -24.84 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 122.317 0.247 . . . . 0.0 110.627 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.0 -39.95 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 171.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.2 t -62.92 -43.61 98.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.631 0.772 . . . . 0.0 111.009 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -72.53 -38.36 68.05 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.567 0.747 . . . . 0.0 111.376 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.14 -46.09 75.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.291 0.636 . . . . 0.0 109.795 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.7 t -63.37 -31.8 73.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.123 0.969 . . . . 0.0 111.258 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.66 -46.57 87.61 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HG2' HG12 ' A' ' 34' ' ' VAL . 0.1 OUTLIER -71.67 -35.88 70.45 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.461 -177.257 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.53 -42.55 78.33 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.847 0.459 . . . . 0.0 110.011 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 76' ' ' THR . 2.0 tmt_? -64.56 -48.22 75.83 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.302 1.041 . . . . 0.0 110.221 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -82.31 -67.13 0.81 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.312 -175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -77.77 -47.73 18.28 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.84 -164.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.45 ' CE1' HG23 ' A' ' 34' ' ' VAL . 80.2 m-85 -79.53 -24.43 42.2 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.047 0.539 . . . . 0.0 110.982 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.0 -5.22 83.64 Favored Glycine 0 C--N 1.349 1.287 0 O-C-N 123.279 0.362 . . . . 0.0 113.369 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.441 HG13 HG21 ' A' ' 78' ' ' VAL . 40.7 t -81.9 87.92 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.271 1.029 . . . . 0.0 108.681 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 45.8 p -71.16 134.63 47.1 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.963 -168.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.62 -110.24 3.02 Favored Glycine 0 C--N 1.348 1.227 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.291 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.445 HG12 HD23 ' A' ' 94' ' ' LEU . 10.2 t 69.46 8.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 125.571 1.549 . . . . 0.0 110.823 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -48.61 -41.78 32.01 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.387 1.475 . . . . 0.0 113.146 -168.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.52 -46.91 71.48 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.365 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -73.91 -25.0 59.77 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.69 0.396 . . . . 0.0 110.838 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.15 -32.62 70.67 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.978 0.911 . . . . 0.0 110.418 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -68.21 -36.29 79.32 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.072 171.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.91 -1.75 36.66 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.542 0.737 . . . . 0.0 112.589 177.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.468 HD11 HD11 ' A' ' 94' ' ' LEU . 65.7 mt -80.76 151.81 28.62 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.284 0.493 . . . . 0.0 111.599 176.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -132.45 -44.81 0.91 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 109.361 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.543 HG22 ' HD3' ' A' ' 51' ' ' ARG . 64.1 p -117.4 156.4 27.98 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.443 0.697 . . . . 0.0 110.852 -177.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 90.6 t -67.9 -33.16 59.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.15 174.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.22 -38.96 81.24 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.089 0.956 . . . . 0.0 110.589 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.07 -31.88 66.52 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.147 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.433 HD21 HD21 ' A' ' 31' ' ' LEU . 44.1 tp -67.39 -33.9 76.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.124 0.57 . . . . 0.0 110.874 173.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -68.32 -38.96 82.08 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.93 0.492 . . . . 0.0 110.945 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -69.01 -29.18 67.31 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 175.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.468 HD11 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -65.24 -59.52 3.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.648 0.779 . . . . 0.0 109.31 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 86.0 t -58.67 -30.88 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.004 0.922 . . . . 0.0 111.076 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.98 -52.84 63.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.12 0.968 . . . . 0.0 111.097 175.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.476 ' HB3' ' HZ3' ' A' ' 97' ' ' LYS . 9.7 mtpm? -68.9 -30.05 68.45 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.533 0.733 . . . . 0.0 111.331 -177.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -83.14 -17.46 42.92 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.699 0.8 . . . . 0.0 111.612 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -83.22 -33.76 26.04 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.77 -35.59 72.68 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.718 0.807 . . . . 0.0 110.631 177.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -151.08 111.41 4.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.4 1.08 . . . . 0.0 108.126 175.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.27 23.56 3.28 Favored Glycine 0 N--CA 1.483 1.796 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 -174.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 6.8 p . . . . . 0 CA--C 1.554 1.114 0 C-N-CA 125.179 1.392 . . . . 0.0 108.067 178.583 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.419 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.73 54.13 0.01 OUTLIER Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.0 t -146.41 141.87 27.6 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.948 0.899 . . . . 0.0 109.782 -178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.7 p -80.37 105.84 11.93 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -81.67 164.86 21.51 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 110.153 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -62.13 -51.22 68.76 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.707 0.63 . . . . 0.0 111.944 -172.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -160.18 170.84 20.34 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 120.97 0.414 . . . . 0.0 111.216 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -127.01 140.69 52.12 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.525 1.13 . . . . 0.0 109.619 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -158.35 116.74 3.03 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.877 . . . . 0.0 109.091 175.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -95.25 124.93 39.54 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -91.02 59.41 4.04 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.656 0.741 . . . . 0.0 109.122 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.4 p -151.63 177.95 9.84 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.99 -174.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 85.8 -64.57 4.07 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 -178.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -87.1 -176.42 5.7 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.711 0.805 . . . . 0.0 110.039 174.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 62.97 24.02 14.33 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.484 1.114 . . . . 0.0 110.028 -178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -93.24 10.09 33.38 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.414 1.085 . . . . 0.0 111.001 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mp -77.7 99.95 6.03 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.042 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -77.67 138.84 39.31 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.502 0.721 . . . . 0.0 110.412 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -74.54 -26.7 60.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.825 0.85 . . . . 0.0 110.96 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -97.27 26.89 4.48 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.057 0.943 . . . . 0.0 110.534 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -153.51 107.77 0.34 Allowed Glycine 0 C--N 1.343 0.953 0 N-CA-C 111.782 -0.527 . . . . 0.0 111.782 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -71.1 -47.54 57.53 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.238 0.519 . . . . 0.0 110.217 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 83.0 mtp -148.04 105.8 3.63 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 124.792 1.237 . . . . 0.0 108.397 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.74 144.57 49.15 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 122.061 1.841 . . . . 0.0 111.325 173.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -71.44 -19.96 62.16 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.371 0.668 . . . . 0.0 109.844 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.5 t70 74.83 148.8 0.1 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.608 1.563 . . . . 0.0 112.061 171.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 19.7 ttt -70.42 -54.83 10.8 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.425 176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -61.67 -57.73 10.82 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.222 1.009 . . . . 0.0 112.784 -167.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.65 -43.09 99.51 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.558 0.536 . . . . 0.0 110.679 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -67.2 -32.0 72.77 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.048 0.842 . . . . 0.0 111.308 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 24.1 tp -64.83 -45.06 87.72 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.36 -31.24 72.26 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.202 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.3 m -67.66 -42.13 82.67 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.829 0.452 . . . . 0.0 109.939 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.494 HG11 ' HG3' ' A' ' 68' ' ' LYS . 22.3 t -60.84 -44.57 97.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.352 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 53.6 mt -67.94 -32.18 72.45 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.693 0.62 . . . . 0.0 110.908 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.3 t -64.84 -35.94 82.73 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.857 0.723 . . . . 0.0 111.072 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.2 t -82.92 -25.55 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.898 0.879 . . . . 0.0 110.68 178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -82.91 -27.56 30.55 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.463 0.705 . . . . 0.0 111.904 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.1 p -107.07 -55.28 2.35 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.056 0.542 . . . . 0.0 110.544 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 130.86 -29.84 3.48 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.47 -178.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 m -79.03 140.9 57.91 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.685 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.505 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 37.7 Cg_endo -63.86 170.53 8.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.108 2.539 . . . . 0.0 113.323 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.21 -22.11 66.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.074 0.95 . . . . 0.0 111.705 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.68 -29.38 66.8 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.105 0.562 . . . . 0.0 110.835 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.505 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 11.4 mm-40 -92.5 6.33 47.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.346 0.658 . . . . 0.0 110.755 176.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -127.22 99.23 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.1 0.96 . . . . 0.0 108.821 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.483 ' OG ' ' HB2' ' A' ' 50' ' ' SER . 57.8 p -98.68 150.64 21.57 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -66.68 -24.29 66.25 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.9 0.88 . . . . 0.0 112.2 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -99.68 1.2 43.25 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.912 0.885 . . . . 0.0 111.18 -175.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.483 ' HB2' ' OG ' ' A' ' 47' ' ' SER . 9.0 t -83.35 170.21 14.81 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 123.438 0.695 . . . . 0.0 111.921 -176.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -67.68 147.65 52.38 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.149 165.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.62 ' HG3' ' HB2' ' A' ' 55' ' ' LEU . 19.8 ttt -102.29 -77.73 0.55 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.296 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 38.07 -80.07 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 113.896 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.12 -30.02 64.03 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.052 0.541 . . . . 0.0 112.218 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.62 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 51.1 mt -70.75 -25.5 62.94 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.448 0.699 . . . . 0.0 112.345 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -170.35 96.6 0.25 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.067 0.947 . . . . 0.0 110.766 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -168.07 49.19 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 177.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -161.94 134.81 6.02 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.986 -171.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.6 p -47.71 -46.7 29.87 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.647 1.179 . . . . 0.0 113.377 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.34 -39.81 74.47 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.588 0.355 . . . . 0.0 110.789 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.31 -34.86 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 123.254 0.347 . . . . 0.0 110.666 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.516 HG11 ' HB2' ' A' ' 82' ' ' LEU . 75.0 t -69.51 -39.06 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.914 0.885 . . . . 0.0 110.203 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.3 m -64.47 -44.58 90.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.402 0.681 . . . . 0.0 110.09 175.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -64.89 -44.84 88.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.28 1.032 . . . . 0.0 110.819 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.0 tp -69.21 -38.7 78.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.036 0.934 . . . . 0.0 110.407 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.0 t -61.13 -38.66 87.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.471 0.709 . . . . 0.0 110.68 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.478 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 94.0 mt -63.55 -48.75 76.21 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.875 0.735 . . . . 0.0 110.625 175.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.494 ' HG3' HG11 ' A' ' 34' ' ' VAL . 75.3 mmtt -59.72 -47.77 84.34 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.093 0.557 . . . . 0.0 111.196 -178.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.58 -29.78 69.22 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.516 0.727 . . . . 0.0 111.347 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.69 -53.06 37.63 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.197 0.999 . . . . 0.0 111.115 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 4.0 mptp? -72.4 -41.54 66.16 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.557 -177.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -82.2 -53.99 5.62 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.303 0.641 . . . . 0.0 112.175 -170.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -107.14 -14.77 14.83 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.157 0.583 . . . . 0.0 112.063 -171.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.28 -6.14 77.46 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 122.908 0.29 . . . . 0.0 112.885 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.566 HG12 HG21 ' A' ' 78' ' ' VAL . 46.0 t -80.93 80.12 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.082 0.953 . . . . 0.0 109.821 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 t -91.32 160.75 15.34 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.28 0.632 . . . . 0.0 111.251 -174.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.49 -110.97 3.15 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.566 HG21 HG12 ' A' ' 75' ' ' VAL . 3.4 t 58.15 26.19 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 125.231 1.412 . . . . 0.0 111.1 173.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -51.37 -57.67 8.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.25 1.42 . . . . 0.0 112.987 -166.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -60.0 -43.49 95.17 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.071 0.857 . . . . 0.0 110.88 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.55 ' HB2' HG13 ' A' ' 78' ' ' VAL . 38.4 mt-10 -69.77 -40.95 75.77 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.036 0.535 . . . . 0.0 111.105 -173.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.516 ' HB2' HG11 ' A' ' 62' ' ' VAL . 76.6 mt -69.95 -25.16 63.51 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.948 0.499 . . . . 0.0 111.177 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.79 -16.51 31.93 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.181 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.31 10.31 41.67 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.802 0.841 . . . . 0.0 110.052 -177.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.44 HD12 ' SD ' ' A' ' 52' ' ' MET . 24.7 mt -69.29 115.46 8.58 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -173.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -91.23 -53.41 4.37 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.07 -178.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.5 p -127.04 158.41 37.03 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.795 0.838 . . . . 0.0 110.714 -177.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -66.06 -38.55 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -56.46 -34.23 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.328 1.051 . . . . 0.0 111.533 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.2 -40.62 86.49 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.264 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.572 HD21 ' HE3' ' A' ' 52' ' ' MET . 63.4 tp -64.1 -34.46 78.08 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 123.673 0.608 . . . . 0.0 111.472 176.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -59.99 -52.53 65.01 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.798 0.439 . . . . 0.0 110.733 174.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -71.72 -19.29 62.07 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.792 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.537 HD22 HG11 ' A' ' 78' ' ' VAL . 8.2 tt -71.74 -57.69 4.14 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.706 0.802 . . . . 0.0 109.106 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.91 -31.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.325 0.65 . . . . 0.0 110.101 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -70.61 -37.71 73.87 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.631 0.773 . . . . 0.0 109.684 174.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.992 0.517 . . . . 0.0 109.822 177.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -72.9 -32.42 65.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.748 0.819 . . . . 0.0 111.25 176.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -66.09 -44.89 83.08 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.614 0.766 . . . . 0.0 110.096 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.58 64.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.286 1.034 . . . . 0.0 110.535 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.62 -17.83 61.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.481 0.712 . . . . 0.0 111.144 175.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 62.54 3.87 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.466 0.479 . . . . 0.0 112.45 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 CA--C 1.554 1.121 0 C-N-CA 124.1 0.96 . . . . 0.0 109.101 -178.774 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.459 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -170.69 151.57 16.48 Favored Glycine 0 C--N 1.34 0.752 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.3 p -137.66 160.52 38.97 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.419 0.688 . . . . 0.0 110.688 -178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -111.89 80.85 1.37 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.803 0.841 . . . . 0.0 109.469 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -99.7 -52.03 3.57 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 68.13 144.57 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.348 1.459 . . . . 0.0 113.047 173.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -113.35 8.81 18.11 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.045 171.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.5 t60 -73.65 97.95 2.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.303 1.041 . . . . 0.0 110.176 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -158.04 116.53 3.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.413 0.685 . . . . 0.0 110.365 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -98.23 147.6 24.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.028 0.931 . . . . 0.0 109.505 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.0 t -135.2 166.89 22.05 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.411 0.684 . . . . 0.0 109.816 173.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.7 t -152.93 172.82 16.22 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.257 1.023 . . . . 0.0 108.693 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 175.49 126.53 0.95 Allowed Glycine 0 C--N 1.339 0.702 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -119.17 154.11 33.83 Favored 'General case' 0 C--O 1.247 0.926 0 C-N-CA 123.489 0.716 . . . . 0.0 110.475 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -69.73 114.95 8.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.531 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -94.09 127.54 39.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.644 0.378 . . . . 0.0 110.009 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 98.2 mt -119.67 104.54 10.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.574 0.749 . . . . 0.0 109.074 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -120.42 137.02 54.55 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.238 1.015 . . . . 0.0 109.204 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -68.65 110.72 4.39 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 123.596 0.758 . . . . 0.0 110.14 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -88.03 98.68 11.66 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.573 0.749 . . . . 0.0 109.389 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.29 107.07 2.87 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.354 -0.385 . . . . 0.0 112.325 178.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -164.51 100.57 0.81 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.442 1.097 . . . . 0.0 108.232 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tpt -76.01 111.5 15.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.706 0.803 . . . . 0.0 109.504 177.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -86.66 83.74 1.11 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 122.831 2.354 . . . . 0.0 111.651 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -137.39 83.22 1.98 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.695 0.798 . . . . 0.0 109.426 -175.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -164.38 150.21 10.59 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.032 0.533 . . . . 0.0 109.993 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ttt -57.29 -52.56 64.83 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.866 0.867 . . . . 0.0 111.174 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.417 ' HG2' ' CE1' ' A' ' 92' ' ' PHE . 9.2 tm-20 -62.37 -39.92 94.76 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.879 0.872 . . . . 0.0 109.857 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -59.16 -50.78 72.73 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.225 0.61 . . . . 0.0 111.119 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.404 ' O ' HG22 ' A' ' 34' ' ' VAL . 34.8 m-70 -64.74 -36.47 84.4 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.267 0.627 . . . . 0.0 110.886 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.48 -37.41 74.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.76 -28.66 63.79 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.997 0.919 . . . . 0.0 110.187 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.6 m -71.98 -42.65 66.26 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.278 1.031 . . . . 0.0 109.952 174.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 30' ' ' HIS . 37.1 t -55.3 -46.14 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 123.567 0.747 . . . . 0.0 109.966 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.7 mt -62.14 -43.49 98.71 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.042 176.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.4 t -65.07 -34.83 79.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.033 0.933 . . . . 0.0 111.892 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.02 -37.45 17.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.481 0.712 . . . . 0.0 109.984 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.85 -26.83 59.97 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.649 0.78 . . . . 0.0 111.861 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.8 p -96.46 -41.57 8.52 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.625 0.77 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.65 -15.11 62.42 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.374 -173.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.0 m -86.76 147.05 42.56 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 123.16 0.584 . . . . 0.0 110.342 -179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -52.78 155.52 10.59 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.128 2.552 . . . . 0.0 113.956 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -63.57 -26.17 68.57 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.292 0.637 . . . . 0.0 111.139 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.01 -31.14 71.49 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.794 0.838 . . . . 0.0 111.413 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.57 -30.44 64.4 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.511 0.724 . . . . 0.0 110.537 176.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -89.67 97.12 6.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.889 -174.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -79.58 156.92 27.48 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 167.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.49 -30.28 69.07 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.22 87.04 6.35 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.2 t -142.83 142.57 31.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.708 0.803 . . . . 0.0 108.898 172.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -85.86 18.24 3.05 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.011 0.924 . . . . 0.0 112.013 -176.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.548 ' HE3' HD11 ' A' ' 85' ' ' LEU . 49.1 mtt 60.72 24.45 14.29 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 124.287 1.035 . . . . 0.0 112.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -32.92 -58.61 0.36 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 126.286 1.834 . . . . 0.0 113.497 -169.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.72 9.75 4.64 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.389 -0.823 . . . . 0.0 108.901 172.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.03 -42.4 17.53 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.701 0.8 . . . . 0.0 112.028 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.411 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -150.5 -1.94 0.38 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -86.31 76.56 9.66 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -179.8 136.3 0.12 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.275 1.43 . . . . 0.0 108.32 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.2 p -58.23 -36.84 73.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.134 0.974 . . . . 0.0 113.144 -173.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.39 -38.37 74.68 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.9 t -71.58 -31.13 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.413 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 66.7 t -69.33 -34.58 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.693 0.797 . . . . 0.0 110.168 174.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.6 t -73.76 -33.72 64.4 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.192 0.597 . . . . 0.0 110.585 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.7 -39.91 84.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.354 0.661 . . . . 0.0 109.538 173.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.444 HD13 HD23 ' A' ' 91' ' ' LEU . 59.3 tp -63.22 -51.87 64.5 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.62 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 62.0 p -62.63 -36.32 82.43 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.874 0.87 . . . . 0.0 111.376 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.9 tp -64.95 -41.72 95.25 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.741 0.65 . . . . 0.0 110.854 175.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -69.09 -35.94 77.04 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.289 0.635 . . . . 0.0 111.271 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 88.2 mt -67.75 -32.9 73.82 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.911 0.485 . . . . 0.0 110.038 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -30.88 71.9 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.768 1.227 . . . . 0.0 111.289 175.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -93.59 -61.77 1.49 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.089 0.555 . . . . 0.0 111.335 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -61.6 -47.76 84.0 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.701 1.2 . . . . 0.0 112.063 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -108.64 -18.88 13.61 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 -172.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.2 -13.41 54.92 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-O 120.095 -0.281 . . . . 0.0 113.25 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.61 100.57 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.764 0.826 . . . . 0.0 109.206 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 39.7 m -90.78 141.38 28.87 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.836 0.854 . . . . 0.0 111.794 -169.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.39 -107.72 2.68 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.819 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.522 HG12 ' HB2' ' A' ' 81' ' ' GLU . 3.7 t 64.55 15.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.94 1.296 . . . . 0.0 110.883 177.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.64 -28.39 67.19 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.578 1.151 . . . . 0.0 113.457 -166.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -63.27 -51.36 66.47 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 123.68 0.613 . . . . 0.0 110.281 175.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HB2' HG12 ' A' ' 78' ' ' VAL . 4.4 mp0 -68.9 -31.94 71.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.154 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.1 mt -73.17 -18.03 61.31 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -78.34 -35.86 47.02 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.434 0.694 . . . . 0.0 109.596 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.79 2.1 10.95 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.561 0.744 . . . . 0.0 112.499 176.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.616 HD13 HD11 ' A' ' 91' ' ' LEU . 38.8 mt -70.05 140.72 52.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.024 0.529 . . . . 0.0 112.007 172.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.41 -51.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.416 0 O-C-N 124.509 1.131 . . . . 0.0 108.206 170.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.7 p -102.87 149.07 24.87 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.129 0.572 . . . . 0.0 110.679 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.481 ' HA ' ' HE1' ' A' ' 52' ' ' MET . 4.0 m -67.38 -26.73 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.615 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.52 -45.55 77.11 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.817 . . . . 0.0 110.528 169.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.86 -40.8 85.4 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-N 114.854 -1.067 . . . . 0.0 109.877 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.616 HD11 HD13 ' A' ' 85' ' ' LEU . 47.0 tp -65.87 -39.26 90.53 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.659 0.783 . . . . 0.0 112.425 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.417 ' CE1' ' HG2' ' A' ' 28' ' ' GLU . 60.4 m-85 -62.06 -36.99 83.32 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.569 ' HA ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -82.95 -23.13 33.57 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.706 0.802 . . . . 0.0 112.271 178.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 tt -74.45 -55.37 6.04 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.55 -37.28 74.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.032 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.52 -45.75 84.63 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 123.948 0.78 . . . . 0.0 111.233 173.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -57.85 -48.47 79.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.922 0.889 . . . . 0.0 111.072 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -82.25 -33.83 29.07 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.621 -174.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.08 -42.07 48.49 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.57 -54.07 49.91 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.166 0.587 . . . . 0.0 110.28 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 65.64 156.38 0.09 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.773 1.229 . . . . 0.0 113.304 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.56 -25.63 11.87 Favored Glycine 0 N--CA 1.471 1.012 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.6 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 55.4 m . . . . . 0 CA--C 1.548 0.901 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 174.102 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.801 0.334 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.25 105.82 0.24 Allowed Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 m -82.86 115.17 21.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.724 0.81 . . . . 0.0 110.2 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.2 m -70.16 89.51 0.64 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.419 0.687 . . . . 0.0 109.787 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -86.56 118.1 25.76 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.28 149.85 24.77 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.091 0.956 . . . . 0.0 110.965 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -141.05 73.77 1.43 Allowed 'General case' 0 C--N 1.351 0.646 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -79.89 169.13 18.34 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.688 166.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -133.75 138.93 46.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.086 0.954 . . . . 0.0 109.047 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -74.05 126.48 30.6 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.25 0.62 . . . . 0.0 110.308 -178.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.9 p -72.34 88.7 1.19 Allowed 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 171.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.9 t -111.94 10.87 20.61 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.515 1.126 . . . . 0.0 110.851 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.19 82.54 0.65 Allowed Glycine 0 C--N 1.347 1.176 0 O-C-N 123.162 0.289 . . . . 0.0 112.965 -175.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.4 -83.5 0.22 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 175.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 54.47 -159.52 0.17 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.343 1.057 . . . . 0.0 111.848 174.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 51.69 85.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.053 1.341 . . . . 0.0 112.574 172.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.69 108.89 3.09 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.072 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 28.3 p90 -71.15 121.65 18.7 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.676 1.19 . . . . 0.0 111.354 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -133.96 98.77 4.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.034 0.933 . . . . 0.0 108.879 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 55.34 71.51 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.434 1.094 . . . . 0.0 110.981 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.71 -84.83 0.06 OUTLIER Glycine 0 C--N 1.353 1.497 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.972 -174.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.1 t60 52.86 79.09 0.12 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.725 1.21 . . . . 0.0 110.608 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.2 ptp -125.08 97.85 37.12 Favored Pre-proline 0 N--CA 1.479 1.019 0 CA-C-O 121.133 0.492 . . . . 0.0 111.128 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.25 176.54 8.66 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.492 2.128 . . . . 0.0 110.942 168.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -77.38 -57.54 3.77 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.7 t70 65.87 164.95 0.18 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.878 1.271 . . . . 0.0 111.666 173.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 ttp -122.33 -44.1 2.27 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.461 -0.775 . . . . 0.0 111.01 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.99 -61.93 1.68 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.899 0.88 . . . . 0.0 112.069 -171.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -65.2 -30.92 71.86 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.704 0.802 . . . . 0.0 110.478 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -63.17 -41.1 99.17 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.741 0.817 . . . . 0.0 109.584 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.517 HD23 ' HG ' ' A' ' 91' ' ' LEU . 39.2 tp -66.69 -38.92 87.75 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.184 0.994 . . . . 0.0 110.003 177.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.5 tp -62.23 -38.74 90.38 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.489 1.116 . . . . 0.0 110.777 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.3 m -66.56 -42.37 87.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.114 0.966 . . . . 0.0 110.684 176.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -57.87 -45.88 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.697 0.799 . . . . 0.0 110.861 177.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 83.5 mt -63.04 -37.94 89.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.519 0.728 . . . . 0.0 111.133 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -61.89 -37.98 86.63 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.509 0.724 . . . . 0.0 111.242 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 56.7 t -79.72 -32.91 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.506 0.723 . . . . 0.0 110.539 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.19 -14.07 58.74 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.757 0.823 . . . . 0.0 111.914 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.462 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 18.4 m -112.24 -38.86 4.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.256 0.622 . . . . 0.0 110.847 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.7 -30.28 10.58 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.008 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.62 137.84 88.33 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.289 0.635 . . . . 0.0 110.364 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.71 161.44 10.06 Favored 'Trans proline' 0 C--N 1.379 2.138 0 C-N-CA 123.46 2.773 . . . . 0.0 113.802 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.92 -29.42 70.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.713 0.805 . . . . 0.0 111.214 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.53 -18.22 64.32 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 111.609 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -89.49 -20.08 24.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.415 0.686 . . . . 0.0 111.175 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.434 HG23 HD13 ' A' ' 55' ' ' LEU . 34.4 mt -102.43 105.04 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.975 0.51 . . . . 0.0 110.892 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.9 p -95.27 -178.02 4.31 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 165.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.721 ' HA ' ' HB ' ' A' ' 88' ' ' VAL . 11.0 ptp180 -84.73 -11.53 55.64 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.596 -0.69 . . . . 0.0 111.25 175.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.99 13.45 28.91 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.607 0.763 . . . . 0.0 110.456 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -85.02 18.34 2.54 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.259 0.624 . . . . 0.0 112.577 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 68.12 167.01 0.25 Allowed 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.145 175.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.493 ' HG3' ' HB3' ' A' ' 85' ' ' LEU . 87.9 mmm -121.53 94.47 4.33 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 170.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -137.92 -65.66 0.51 Allowed 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -83.43 -35.14 25.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.245 176.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.462 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 70.1 mt -69.69 -44.11 71.1 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.257 -172.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.92 94.95 0.08 Allowed 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.512 1.133 . . . . 0.0 109.68 169.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -163.64 -37.66 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.088 0.955 . . . . 0.0 108.496 175.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -53.98 139.53 34.05 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.046 0.841 . . . . 0.0 110.041 168.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -47.73 -47.29 30.24 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.103 1.361 . . . . 0.0 113.183 -173.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.3 mt -80.36 -25.83 38.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.872 -174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.1 t -77.29 -29.24 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 123.174 0.296 . . . . 0.0 110.207 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.4 t -70.14 -44.68 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.619 0.768 . . . . 0.0 109.897 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.8 p -67.76 -33.58 75.13 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.548 0.53 . . . . 0.0 110.777 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.63 -47.65 74.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.758 0.823 . . . . 0.0 110.422 175.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.8 tp -68.89 -40.48 79.18 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 -174.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 66.5 m -62.6 -48.38 79.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.978 0.511 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.3 tp -57.05 -36.23 70.26 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.865 0.728 . . . . 0.0 110.483 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 68' ' ' LYS . 6.0 tppt? -68.61 -52.93 26.11 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.368 178.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.482 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 83.6 mt -52.01 -44.11 63.99 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.11 0.964 . . . . 0.0 111.532 -175.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -61.06 -36.93 80.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.472 1.109 . . . . 0.0 111.92 -174.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -97.92 -64.87 1.0 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.964 0.506 . . . . 0.0 110.905 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.86 -40.62 63.58 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.704 1.602 . . . . 0.0 113.24 -173.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -120.57 -14.79 8.59 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -171.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.85 16.42 79.34 Favored Glycine 0 CA--C 1.534 1.249 0 N-CA-C 113.862 0.305 . . . . 0.0 113.862 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.604 HG21 HG11 ' A' ' 95' ' ' VAL . 59.1 t -93.87 136.16 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 123.86 0.864 . . . . 0.0 108.854 176.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -67.37 156.99 35.13 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 122.736 0.415 . . . . 0.0 111.4 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.16 88.28 0.15 Allowed Glycine 0 C--N 1.357 1.699 0 O-C-N 123.41 0.444 . . . . 0.0 112.994 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.6 m -94.14 47.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.312 1.045 . . . . 0.0 111.226 -174.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -48.12 -39.85 21.76 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.409 1.484 . . . . 0.0 113.963 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.99 -52.45 65.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.335 1.054 . . . . 0.0 110.085 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.11 -25.71 61.85 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -176.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.23 -31.09 70.34 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.856 0.463 . . . . 0.0 110.85 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.53 -26.45 45.75 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.776 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -90.21 12.97 16.42 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.908 0.483 . . . . 0.0 112.22 176.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.495 HD22 HD23 ' A' ' 94' ' ' LEU . 94.1 mt -80.09 148.42 31.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.665 0.386 . . . . 0.0 110.63 172.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -115.47 -55.88 2.4 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.587 0.755 . . . . 0.0 109.858 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.3 p -119.44 163.61 16.99 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.896 0.879 . . . . 0.0 109.637 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.721 ' HB ' ' HA ' ' A' ' 48' ' ' ARG . 11.0 t -69.63 -23.25 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 30.6 t70 -57.12 -48.45 78.62 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.372 0.669 . . . . 0.0 109.739 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -55.75 -39.21 70.85 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.085 0.866 . . . . 0.0 111.265 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.517 ' HG ' HD23 ' A' ' 31' ' ' LEU . 44.4 tp -63.42 -48.45 77.74 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 123.707 0.63 . . . . 0.0 111.601 176.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -60.46 -34.75 74.46 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.363 0.665 . . . . 0.0 110.932 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 16.7 mm100 -75.91 -36.68 59.34 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.608 0.567 . . . . 0.0 110.501 177.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.495 HD23 HD22 ' A' ' 85' ' ' LEU . 26.7 tp -61.2 -53.47 56.46 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.448 0.699 . . . . 0.0 109.748 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.604 HG11 HG21 ' A' ' 75' ' ' VAL . 84.7 t -61.8 -34.73 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.659 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.43 -62.53 1.78 Allowed 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.607 0.763 . . . . 0.0 111.476 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -38.66 90.42 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.881 0.473 . . . . 0.0 111.66 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -74.44 -25.27 59.32 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.308 0.643 . . . . 0.0 112.713 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -88.28 -35.25 17.35 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.549 0.34 . . . . 0.0 110.319 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.93 -31.17 66.08 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.447 0.699 . . . . 0.0 110.77 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 55.61 34.81 23.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.885 1.274 . . . . 0.0 111.7 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -63.69 -18.29 61.43 Favored Glycine 0 C--N 1.355 1.613 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.966 -175.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.248 0.999 0 C-N-CA 124.066 0.946 . . . . 0.0 108.75 175.679 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.69 47.47 0.02 OUTLIER Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.831 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.8 p -72.77 117.3 14.31 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 122.937 0.495 . . . . 0.0 110.013 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.7 m -139.76 128.47 23.18 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.679 0.792 . . . . 0.0 109.379 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -143.85 121.86 12.09 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -126.7 163.95 22.38 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.285 0.634 . . . . 0.0 109.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -130.91 26.14 4.96 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.159 0.983 . . . . 0.0 110.362 -173.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -74.19 80.12 1.79 Allowed 'General case' 0 CA--C 1.556 1.194 0 CA-C-O 122.114 0.959 . . . . 0.0 111.376 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -156.19 -34.3 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.22 1.408 . . . . 0.0 108.759 176.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -103.17 113.73 27.44 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -139.06 33.48 2.14 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.805 0.842 . . . . 0.0 109.074 -179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.2 m -60.91 118.63 6.93 Favored 'General case' 0 C--N 1.354 0.773 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.119 -176.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -165.75 167.34 39.05 Favored Glycine 0 C--N 1.336 0.543 0 O-C-N 123.771 0.669 . . . . 0.0 111.916 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.4 ttm105 -86.66 125.07 33.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.933 0.893 . . . . 0.0 110.787 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.45 133.09 35.2 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 164.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -79.36 75.92 5.94 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.284 0.564 . . . . 0.0 110.753 -172.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -96.02 103.03 14.9 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.903 0.881 . . . . 0.0 108.696 174.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -80.81 -70.64 0.51 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 63.84 141.4 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.452 1.501 . . . . 0.0 111.964 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.1 tm0? -139.64 116.63 11.02 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 162.35 176.97 34.98 Favored Glycine 0 C--N 1.342 0.893 0 O-C-N 123.857 0.723 . . . . 0.0 112.008 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -124.24 -18.5 5.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.699 0.8 . . . . 0.0 111.069 -178.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 69.47 169.77 0.11 Allowed Pre-proline 0 N--CA 1.493 1.682 0 C-N-CA 124.354 1.062 . . . . 0.0 108.902 -160.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -59.37 -91.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 121.713 1.609 . . . . 0.0 112.861 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 177.09 24.53 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.611 1.164 . . . . 0.0 108.807 -176.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -80.07 -61.49 1.97 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.756 1.222 . . . . 0.0 112.156 -167.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.535 ' SD ' HD11 ' A' ' 31' ' ' LEU . 19.4 tmm? -172.54 -39.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.11 0.964 . . . . 0.0 108.839 -167.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -59.1 -49.83 76.39 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.066 0.546 . . . . 0.0 110.831 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -49.72 -40.53 40.95 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.345 1.058 . . . . 0.0 111.536 171.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.12 -38.47 69.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.613 0.765 . . . . 0.0 111.287 -173.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.535 HD11 ' SD ' ' A' ' 27' ' ' MET . 11.1 mp -69.75 -33.29 72.23 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 117.973 0.351 . . . . 0.0 110.758 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.34 -33.9 77.06 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.428 0.455 . . . . 0.0 110.41 172.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.9 m -71.88 -39.82 69.36 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.214 0.605 . . . . 0.0 110.337 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.0 t -58.51 -49.63 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.797 0.839 . . . . 0.0 110.042 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.25 -28.3 66.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.628 0.771 . . . . 0.0 111.556 177.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 29.9 t -66.1 -38.17 87.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.842 0.457 . . . . 0.0 111.015 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.2 t -87.17 -30.12 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.09 47.82 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.233 0.613 . . . . 0.0 112.032 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.2 m -108.62 -26.0 10.6 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.184 0.594 . . . . 0.0 111.495 -175.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.49 -27.48 19.35 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-O 119.997 -0.335 . . . . 0.0 112.83 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 36' ' ' SER . 36.0 m -73.0 141.11 81.21 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 123.16 0.584 . . . . 0.0 110.214 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.42 165.63 29.92 Favored 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 122.354 2.036 . . . . 0.0 112.163 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -60.86 -23.31 65.05 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.907 0.883 . . . . 0.0 111.999 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.41 -29.18 65.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.197 0.999 . . . . 0.0 110.887 -176.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -79.66 -11.08 59.87 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.732 0.813 . . . . 0.0 111.343 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.0 mt -110.24 146.78 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.852 0.861 . . . . 0.0 109.743 -174.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.8 p -145.27 157.21 44.11 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 171.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -66.08 -22.51 66.41 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 117.759 0.254 . . . . 0.0 111.145 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -112.07 92.63 4.1 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 171.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -159.34 160.99 35.69 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.317 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmm180 -84.66 129.65 34.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.875 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.537 ' HE1' ' HA ' ' A' ' 88' ' ' VAL . 28.0 mtt -88.58 56.12 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.069 0.948 . . . . 0.0 110.116 174.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.415 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 21.4 mm-40 -71.13 -16.85 62.58 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.827 175.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.92 -30.27 0.53 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.267 1.027 . . . . 0.0 110.737 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -73.79 -10.05 59.27 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.95 33.03 0.15 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.793 0.837 . . . . 0.0 109.311 172.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -99.15 -62.1 1.28 Allowed 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.053 -171.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.48 ' HB3' HG23 ' A' ' 61' ' ' VAL . 34.5 t70 -66.8 152.62 45.19 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.991 0.516 . . . . 0.0 111.704 -176.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 m -52.8 -42.71 65.34 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.107 1.363 . . . . 0.0 112.656 -178.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -67.03 -42.23 85.23 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.834 0.709 . . . . 0.0 110.493 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.48 HG23 ' HB3' ' A' ' 58' ' ' ASP . 21.7 t -64.46 -41.86 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 O-C-N 123.693 0.621 . . . . 0.0 110.482 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.8 t -66.53 -38.95 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.977 0.911 . . . . 0.0 110.503 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.6 t -66.81 -42.38 86.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.726 0.81 . . . . 0.0 110.938 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 41.0 mt-10 -74.48 -33.06 62.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.836 0.854 . . . . 0.0 110.588 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.7 tp -65.19 -41.16 94.82 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.018 0.927 . . . . 0.0 109.734 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.8 t -62.73 -46.42 88.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.118 0.967 . . . . 0.0 110.88 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.79 -30.69 70.95 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.068 -176.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 44.8 mmtm -71.11 -59.71 2.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.783 0.433 . . . . 0.0 110.776 175.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.482 HD11 HD13 ' A' ' 91' ' ' LEU . 95.9 mt -60.71 -27.6 68.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.526 0.73 . . . . 0.0 112.242 -174.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.14 -56.13 18.74 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.657 1.183 . . . . 0.0 109.683 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -81.47 -40.56 23.09 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.098 -176.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.29 -45.87 53.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.938 0.895 . . . . 0.0 112.152 -166.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.26 -8.74 7.01 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.025 -176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.53 3.64 90.1 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 120.167 -0.24 . . . . 0.0 113.022 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.51 HG11 HG23 ' A' ' 78' ' ' VAL . 59.2 t -81.89 83.8 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.928 0.891 . . . . 0.0 109.239 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -130.53 159.41 37.19 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.766 1.226 . . . . 0.0 109.009 178.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.51 24.73 62.33 Favored Glycine 0 C--N 1.337 0.638 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -167.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.51 HG23 HG11 ' A' ' 75' ' ' VAL . 28.0 m -122.4 17.47 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.299 1.44 . . . . 0.0 109.903 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.55 ' HA ' HD12 ' A' ' 82' ' ' LEU . 25.6 t70 -63.96 -31.76 73.06 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.704 0.802 . . . . 0.0 112.063 -170.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -60.91 -48.78 80.24 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.023 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -63.57 -37.18 86.34 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.495 0.718 . . . . 0.0 111.429 178.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 79' ' ' ASP . 92.1 mt -62.4 -38.11 88.4 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.002 0.921 . . . . 0.0 111.392 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.28 -24.5 59.27 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.451 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.23 -2.79 58.63 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.699 0.799 . . . . 0.0 111.945 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.9 mt -77.74 115.33 17.41 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.041 0.448 . . . . 0.0 110.403 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -116.45 -1.71 12.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.369 1.068 . . . . 0.0 109.945 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 p -143.24 137.81 29.18 Favored 'General case' 0 C--O 1.257 1.484 0 C-N-CA 124.732 1.213 . . . . 0.0 109.608 -176.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.537 ' HA ' ' HE1' ' A' ' 52' ' ' MET . 53.4 t -64.86 -35.38 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 -176.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.477 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 34.0 t70 -61.93 -35.25 77.86 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.78 0.432 . . . . 0.0 111.001 179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -68.48 -28.11 66.74 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.811 0.444 . . . . 0.0 111.713 176.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.482 HD13 HD11 ' A' ' 69' ' ' LEU . 65.7 tp -61.99 -41.0 97.54 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 123.196 0.31 . . . . 0.0 110.616 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.405 ' HD1' ' O ' ' A' ' 88' ' ' VAL . 25.7 m-85 -66.29 -39.47 89.38 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.42 0.688 . . . . 0.0 111.751 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 61.7 mm-40 -69.55 -35.43 75.4 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.436 HD11 ' HB ' ' A' ' 78' ' ' VAL . 43.2 tp -58.33 -55.43 35.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.011 0.924 . . . . 0.0 110.456 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.38 -46.46 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.785 -177.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.17 -54.63 43.61 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.658 0.783 . . . . 0.0 112.032 -176.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.23 -43.16 82.67 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.393 0.677 . . . . 0.0 111.506 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -75.83 -18.23 59.54 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.349 0.406 . . . . 0.0 112.057 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -86.34 -28.56 23.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.53 -43.7 63.17 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.352 0.661 . . . . 0.0 110.565 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 56.44 42.63 27.25 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.769 1.228 . . . . 0.0 111.47 178.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -63.68 -36.75 93.74 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.056 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 C--O 1.25 1.092 0 C-N-CA 123.879 0.872 . . . . 0.0 109.458 175.355 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.97 49.69 Favored Glycine 0 C--N 1.34 0.776 0 O-C-N 123.682 0.614 . . . . 0.0 113.319 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 p -172.34 170.61 4.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.678 1.191 . . . . 0.0 109.938 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.6 m -72.38 -57.15 4.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.5 t60 56.01 75.59 0.33 Allowed 'General case' 0 C--N 1.36 1.047 0 C-N-CA 124.974 1.309 . . . . 0.0 109.808 -174.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -87.57 146.32 25.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.596 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -72.53 -51.01 21.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.047 0.539 . . . . 0.0 111.298 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -155.03 134.05 12.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.931 0.492 . . . . 0.0 110.488 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -81.68 148.14 29.16 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -73.15 148.32 43.98 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.444 0.298 . . . . 0.0 110.398 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -66.52 -50.23 63.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.187 0.595 . . . . 0.0 110.001 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.1 m -152.47 -67.32 0.16 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.282 1.033 . . . . 0.0 109.845 174.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 74.32 60.57 3.48 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 123.307 0.379 . . . . 0.0 112.356 -175.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -75.36 -37.09 60.83 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.797 0.839 . . . . 0.0 110.947 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -70.48 136.46 49.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.8 0.44 . . . . 0.0 110.126 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -71.25 96.97 1.48 Allowed 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.981 0.912 . . . . 0.0 108.897 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.4 mp 63.41 -153.93 0.33 Allowed 'General case' 0 CA--C 1.557 1.24 0 O-C-N 124.217 0.948 . . . . 0.0 109.215 -172.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -155.0 -59.21 0.11 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 171.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -79.72 106.58 11.85 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.182 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -165.97 110.11 0.81 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 155.22 -34.79 0.66 Allowed Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.657 -0.577 . . . . 0.0 111.657 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.63 66.7 9.6 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.805 0.812 . . . . 0.0 108.838 177.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -169.24 121.61 0.65 Allowed Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.289 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.24 98.33 0.38 Allowed 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.683 2.255 . . . . 0.0 110.876 172.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -65.02 114.82 4.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.829 0.852 . . . . 0.0 110.901 -177.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -70.45 91.98 0.79 Allowed 'General case' 0 C--O 1.242 0.693 0 C-N-CA 124.014 0.926 . . . . 0.0 111.115 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.3 ptm -64.12 -22.56 66.98 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.957 173.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.83 -50.33 67.08 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 124.259 1.023 . . . . 0.0 110.826 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -69.17 -31.99 71.01 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 123.683 0.614 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -65.73 -42.52 90.91 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.692 176.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.4 tt -70.68 -32.68 70.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.86 1.264 . . . . 0.0 109.173 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.7 tp -67.75 -36.72 81.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.162 0.985 . . . . 0.0 109.909 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.1 m -69.99 -36.29 75.05 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.15 0.98 . . . . 0.0 110.766 176.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.53 -46.78 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.384 0.674 . . . . 0.0 110.059 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.403 HD21 HD21 ' A' ' 91' ' ' LEU . 98.4 mt -68.33 -28.56 67.26 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.109 0.964 . . . . 0.0 111.606 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -65.4 -53.71 39.23 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.202 0.601 . . . . 0.0 110.249 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.85 -37.03 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.784 -178.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.83 -50.53 66.31 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.107 0.563 . . . . 0.0 111.33 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m -79.68 -21.0 45.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.277 0.631 . . . . 0.0 111.142 -178.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.35 4.77 83.29 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-O 119.769 -0.462 . . . . 0.0 113.6 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.8 m -105.86 149.39 37.95 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.357 1.063 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.522 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 29.7 Cg_endo -61.75 160.16 30.01 Favored 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 122.176 1.917 . . . . 0.0 112.389 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.18 -20.88 65.81 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.582 0.753 . . . . 0.0 111.649 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -68.86 -20.2 64.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.025 0.93 . . . . 0.0 112.109 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.522 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 18.0 mm-40 -82.24 -29.11 31.48 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.21 0.604 . . . . 0.0 110.527 174.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.2 mt -88.71 90.83 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.54 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.3 t -79.22 -0.64 32.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.562 0.745 . . . . 0.0 111.794 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 mtm180 75.15 -35.78 0.29 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 126.465 1.906 . . . . 0.0 112.067 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -76.97 3.1 12.97 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.25 1.02 . . . . 0.0 111.327 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.7 t -54.17 132.67 43.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.399 1.079 . . . . 0.0 110.825 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -91.99 31.35 1.26 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.773 0.829 . . . . 0.0 111.446 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.728 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 17.0 mmt 62.86 15.94 8.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.147 0.979 . . . . 0.0 112.694 174.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.66 -46.16 89.86 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.475 0.71 . . . . 0.0 112.32 -168.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -124.9 5.45 8.03 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.936 0.894 . . . . 0.0 109.972 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 mp -123.65 122.02 37.05 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.277 0.631 . . . . 0.0 110.235 -169.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.608 ' HB2' ' SD ' ' A' ' 52' ' ' MET . . . 74.2 -28.93 0.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.728 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 50.4 t80 -82.56 -19.45 38.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.539 0.736 . . . . 0.0 112.731 -169.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.86 136.18 57.93 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.703 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.9 m -54.36 -39.66 67.37 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.654 0.782 . . . . 0.0 113.084 -170.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.3 -42.27 93.23 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.39 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 27.2 t -74.99 -23.28 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.402 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.2 t -71.58 -34.03 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 172.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.1 m -69.94 -31.71 69.59 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.467 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -77.33 -29.12 53.35 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.43 0.692 . . . . 0.0 111.224 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -48.05 58.45 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.411 0.685 . . . . 0.0 109.35 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 26.9 p -61.81 -39.0 90.23 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.281 176.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.2 tp -57.62 -52.15 66.58 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.685 0.794 . . . . 0.0 111.325 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -68.78 -61.7 1.7 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.495 -175.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.6 mt -51.69 -35.68 43.65 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.78 0.675 . . . . 0.0 111.89 -176.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 66' ' ' SER . 60.8 ttt180 -55.81 -44.42 77.84 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.004 1.322 . . . . 0.0 112.816 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -100.17 -54.61 2.83 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.191 0.596 . . . . 0.0 111.619 -178.056 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -51.99 -48.7 64.3 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.239 1.416 . . . . 0.0 112.413 -176.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -116.59 -12.2 10.97 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.208 0.603 . . . . 0.0 111.884 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.44 -11.22 59.27 Favored Glycine 0 N--CA 1.473 1.161 0 CA-C-O 120.046 -0.308 . . . . 0.0 113.465 -176.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.666 HG23 HG12 ' A' ' 95' ' ' VAL . 50.6 t -71.7 92.52 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 124.514 1.125 . . . . 0.0 109.989 -174.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -117.66 166.1 12.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.272 0.629 . . . . 0.0 110.936 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.22 65.79 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.575 0.547 . . . . 0.0 113.027 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.3 m -98.8 8.94 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.086 0.955 . . . . 0.0 111.75 -176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.407 ' HA ' HD12 ' A' ' 82' ' ' LEU . 6.8 p-10 -58.38 -33.38 69.54 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.622 1.169 . . . . 0.0 111.509 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -58.71 -57.83 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.68 1.192 . . . . 0.0 110.958 175.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.544 ' HG3' HD13 ' A' ' 94' ' ' LEU . 9.6 pt-20 -77.42 -19.66 55.76 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.03 -174.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 79' ' ' ASP . 34.8 mt -64.41 -39.64 94.25 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.046 0.938 . . . . 0.0 110.233 169.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -67.84 -35.65 78.96 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.484 173.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.51 -4.21 47.46 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.481 0.712 . . . . 0.0 112.744 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 91' ' ' LEU . 87.4 mt -74.91 140.69 43.96 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.776 0.43 . . . . 0.0 111.476 177.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.36 -0.1 5.68 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.222 1.009 . . . . 0.0 109.666 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p -155.09 140.03 17.3 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.305 1.042 . . . . 0.0 110.868 -170.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.3 t -75.77 -33.2 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.025 0.93 . . . . 0.0 111.329 -174.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.58 -38.31 87.09 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.155 0.502 . . . . 0.0 110.705 176.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.29 -29.48 68.27 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.962 0.905 . . . . 0.0 111.528 174.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.51 ' HB2' HD11 ' A' ' 85' ' ' LEU . 33.7 tp -66.72 -38.72 87.27 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.647 0.379 . . . . 0.0 111.553 171.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -61.39 -48.1 82.8 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 174.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -62.85 -30.02 71.19 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.702 0.801 . . . . 0.0 112.447 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.544 HD13 ' HG3' ' A' ' 81' ' ' GLU . 7.1 tt -61.27 -58.18 9.31 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.385 1.074 . . . . 0.0 109.206 175.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.666 HG12 HG23 ' A' ' 75' ' ' VAL . 96.4 t -63.92 -40.37 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.966 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.69 -35.78 80.94 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.711 0.804 . . . . 0.0 111.309 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -66.71 -46.6 75.01 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -72.09 -24.31 61.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.715 0.806 . . . . 0.0 111.456 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.3 -34.0 59.07 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.05 -18.91 38.03 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.543 0.737 . . . . 0.0 111.354 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 64.73 9.79 5.5 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 125.291 1.437 . . . . 0.0 112.059 -172.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 60.61 36.2 91.01 Favored Glycine 0 C--N 1.359 1.824 0 C-N-CA 123.212 0.434 . . . . 0.0 113.058 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 123.428 0.691 . . . . 0.0 110.448 -176.568 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.656 0.265 . . . . 0.0 110.666 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.35 173.81 13.47 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.159 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.5 p -161.85 130.42 4.29 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.053 0.941 . . . . 0.0 109.65 177.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.1 m -82.82 93.83 7.53 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.534 0.733 . . . . 0.0 110.217 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -87.31 123.98 32.87 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.063 0.545 . . . . 0.0 109.89 178.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -72.25 127.31 32.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.054 0.541 . . . . 0.0 109.843 174.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -140.16 147.06 39.6 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -125.03 158.39 33.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.185 0.594 . . . . 0.0 110.535 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -143.21 110.97 5.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.433 1.093 . . . . 0.0 108.633 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -75.5 103.59 5.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.1 p -126.86 147.22 50.06 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.893 0.877 . . . . 0.0 110.559 -177.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -81.18 119.32 23.45 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.5 0.72 . . . . 0.0 109.261 176.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -82.52 59.43 4.93 Favored Glycine 0 C--N 1.349 1.305 0 C-N-CA 122.979 0.323 . . . . 0.0 112.816 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -101.14 12.71 37.09 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 124.071 0.948 . . . . 0.0 110.031 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -73.44 86.22 1.53 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.998 0.919 . . . . 0.0 110.077 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.4 t30 64.98 166.62 0.17 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.808 1.243 . . . . 0.0 111.084 -177.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -151.06 117.27 5.62 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -79.68 89.76 5.17 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -63.49 -55.16 26.29 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.177 0.591 . . . . 0.0 109.914 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -150.97 175.88 11.65 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -54.55 -40.89 71.6 Favored Glycine 0 C--N 1.359 1.855 0 O-C-N 123.208 0.318 . . . . 0.0 113.012 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -81.28 109.44 15.79 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 171.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -106.92 152.38 40.92 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.482 1.113 . . . . 0.0 109.488 176.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -54.07 155.33 15.44 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.087 2.525 . . . . 0.0 113.103 174.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 m120 66.43 101.08 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.003 1.321 . . . . 0.0 109.341 -170.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.59 172.0 14.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.009 0.923 . . . . 0.0 110.482 -177.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -30.48 68.86 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.292 0.637 . . . . 0.0 110.071 174.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.42 -46.35 90.31 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 124.11 0.964 . . . . 0.0 111.423 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.13 -37.32 87.06 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.807 0.692 . . . . 0.0 110.469 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.458 ' O ' HG22 ' A' ' 34' ' ' VAL . 27.5 m170 -72.89 -30.36 63.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.455 0.702 . . . . 0.0 110.734 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.48 -34.65 65.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.151 0.98 . . . . 0.0 108.848 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.15 -31.81 70.73 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.579 175.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.5 m -70.13 -38.84 75.63 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.004 0.922 . . . . 0.0 110.243 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 30' ' ' HIS . 67.5 t -57.87 -50.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.207 0.603 . . . . 0.0 109.713 174.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 81.9 mt -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.005 0.922 . . . . 0.0 112.078 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.4 t -64.26 -48.58 75.2 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.132 0.573 . . . . 0.0 110.661 178.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -77.97 -23.18 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.862 0.865 . . . . 0.0 110.841 -177.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.483 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -79.38 -42.89 24.55 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.435 0.694 . . . . 0.0 111.014 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.3 p -80.52 -53.58 6.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.391 0.676 . . . . 0.0 110.593 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.3 -23.57 6.79 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.853 -174.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.2 m -87.14 149.83 48.26 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 123.582 0.753 . . . . 0.0 109.764 176.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.463 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 69.6 Cg_endo -71.22 165.88 31.01 Favored 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 122.394 2.063 . . . . 0.0 112.164 179.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.15 -26.97 66.7 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.714 0.806 . . . . 0.0 111.406 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.04 -33.33 75.21 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.643 0.777 . . . . 0.0 111.739 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.463 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 13.2 mm-40 -84.91 -18.86 33.36 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.241 0.616 . . . . 0.0 111.734 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.9 mt -97.6 154.19 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.78 0.832 . . . . 0.0 109.66 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 t -155.68 177.13 11.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -59.07 -40.99 86.91 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -79.99 81.34 6.27 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.458 -1.246 . . . . 0.0 108.497 176.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.1 t -162.1 113.95 1.68 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-N 114.278 -1.328 . . . . 0.0 108.388 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -68.37 108.66 3.32 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.546 ' SD ' ' HB1' ' A' ' 56' ' ' ALA . 50.6 ttm -73.47 76.55 1.43 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.206 1.402 . . . . 0.0 110.461 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -123.72 16.32 9.48 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.974 0.909 . . . . 0.0 109.852 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -157.55 -44.68 0.07 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.456 1.102 . . . . 0.0 109.663 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.51 -30.26 68.08 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.927 -170.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.546 ' HB1' ' SD ' ' A' ' 52' ' ' MET . . . -154.84 39.37 0.43 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.238 0.615 . . . . 0.0 110.374 179.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -106.83 -30.96 8.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.855 -176.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.53 140.84 58.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.398 0.679 . . . . 0.0 110.738 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -54.14 -43.54 70.63 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.179 0.992 . . . . 0.0 113.464 -173.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 tt -68.36 -39.0 81.95 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.483 HG13 ' HB1' ' A' ' 38' ' ' ALA . 36.4 t -69.34 -32.9 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 122.984 0.514 . . . . 0.0 111.243 -179.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.9 -40.47 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.246 0.618 . . . . 0.0 109.816 175.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.401 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 33.7 m -64.89 -47.64 77.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.031 176.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.21 -41.18 83.45 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.706 1.202 . . . . 0.0 110.482 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 40.8 tp -64.66 -50.98 64.94 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.29 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -55.48 -47.58 75.91 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.012 0.925 . . . . 0.0 111.966 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 63' ' ' SER . 87.9 mt -66.39 -35.53 80.57 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.457 0.703 . . . . 0.0 111.27 -178.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -73.42 -40.98 63.83 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 123.64 0.587 . . . . 0.0 110.468 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.0 mt -65.9 -36.34 83.12 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.579 0.752 . . . . 0.0 110.2 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 ttp85 -62.46 -51.0 69.23 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.553 1.141 . . . . 0.0 110.966 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -49.37 51.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.466 -174.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -88.15 -53.54 4.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.567 0.747 . . . . 0.0 111.53 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.451 ' HD2' ' HA ' ' A' ' 69' ' ' LEU . 92.8 m-85 -94.59 -13.54 25.86 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.31 0.644 . . . . 0.0 112.155 -171.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.1 5.05 90.02 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 116.915 -0.129 . . . . 0.0 113.106 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.436 HG22 HG12 ' A' ' 95' ' ' VAL . 75.9 t -81.95 111.29 18.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.036 0.934 . . . . 0.0 109.512 -179.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.7 p -62.52 171.55 1.93 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.089 0.955 . . . . 0.0 112.293 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.7 92.49 0.01 OUTLIER Glycine 0 C--N 1.358 1.755 0 O-C-N 124.147 0.904 . . . . 0.0 113.353 -177.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 8.9 m -104.39 37.61 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.371 1.068 . . . . 0.0 110.663 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.55 -41.31 66.33 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.429 1.092 . . . . 0.0 112.29 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -62.93 -44.7 95.35 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.77 0.828 . . . . 0.0 110.609 176.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 25.7 mm-40 -64.92 -31.88 73.33 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.955 178.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 76.0 mt -71.73 -36.72 70.56 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.168 0.587 . . . . 0.0 111.731 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -75.83 -23.2 55.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 110.661 -0.126 . . . . 0.0 110.661 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 81' ' ' GLU . 89.6 mt -68.55 -19.55 64.5 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.3 0.64 . . . . 0.0 111.882 171.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 29.3 mt -82.6 150.66 26.74 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.956 0.503 . . . . 0.0 110.111 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -136.12 -6.1 2.09 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.044 0.938 . . . . 0.0 109.594 175.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.2 m -141.64 154.32 45.3 Favored 'General case' 0 C--O 1.246 0.897 0 C-N-CA 123.027 0.531 . . . . 0.0 110.277 -174.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.04 -32.12 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 123.727 0.811 . . . . 0.0 111.42 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.67 -49.44 67.98 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.074 0.55 . . . . 0.0 110.72 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.01 -37.74 83.6 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.295 -176.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.5 tp -67.29 -47.87 69.33 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.358 0.412 . . . . 0.0 111.848 176.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -59.59 -43.84 93.57 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.556 0.742 . . . . 0.0 111.778 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.7 -31.21 57.08 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.14 0.275 . . . . 0.0 111.479 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.15 -51.23 68.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.984 0.513 . . . . 0.0 110.403 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.436 HG12 HG22 ' A' ' 75' ' ' VAL . 81.1 t -65.47 -42.02 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.847 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -63.65 -45.78 88.6 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 123.672 0.607 . . . . 0.0 111.373 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -73.82 -28.23 61.51 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.212 0.605 . . . . 0.0 111.49 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -81.33 -19.97 41.68 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.681 0.392 . . . . 0.0 110.789 175.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -81.78 -30.63 32.24 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 174.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.5 -30.56 29.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.812 0.845 . . . . 0.0 110.668 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -136.02 89.36 2.48 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.07 0.948 . . . . 0.0 108.798 178.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.02 77.71 1.3 Allowed Glycine 0 C--N 1.352 1.459 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.338 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 CA--C 1.559 1.301 0 C-N-CA 125.24 1.416 . . . . 0.0 110.697 -177.585 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.6 ttt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.31 -41.39 88.91 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 124.51 1.131 . . . . 0.0 111.539 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.68 -45.29 93.47 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.139 0.576 . . . . 0.0 110.721 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -70.3 -33.48 71.6 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.725 0.641 . . . . 0.0 110.696 -175.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.03 -36.31 61.9 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.899 0.88 . . . . 0.0 108.716 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.62 -32.74 74.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.283 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.522 ' HA ' ' HE3' ' A' ' 43' ' ' LYS . 77.9 m -72.57 -38.25 67.97 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.866 0.866 . . . . 0.0 110.627 176.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.29 -45.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.393 0.677 . . . . 0.0 110.127 172.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 71.6 mt -68.82 -37.15 79.01 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.093 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.5 t -67.98 -29.36 68.37 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.375 0.67 . . . . 0.0 111.448 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.4 t -85.23 -43.11 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 123.439 0.696 . . . . 0.0 110.272 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.9 -43.72 87.34 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.534 0.734 . . . . 0.0 111.222 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 13.6 m -81.41 -30.44 33.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.849 0.859 . . . . 0.0 110.169 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.07 -11.29 65.48 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.397 -0.365 . . . . 0.0 113.331 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 33.4 m -91.15 145.16 31.05 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 123.842 0.857 . . . . 0.0 110.61 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -54.88 169.91 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.852 3.034 . . . . 0.0 115.432 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 33' ' ' THR . 44.5 mmtm -60.25 -34.92 74.37 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.115 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.85 -30.95 71.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.314 0.646 . . . . 0.0 111.571 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.55 -4.29 55.6 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mt -127.34 133.29 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.278 0.631 . . . . 0.0 109.507 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.6 t -135.51 167.83 20.36 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.586 0.754 . . . . 0.0 109.44 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -64.38 -55.68 19.45 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.75 89.82 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -170.31 154.26 4.76 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.197 -1.365 . . . . 0.0 108.457 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -94.25 153.34 18.09 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 123.79 0.836 . . . . 0.0 109.472 177.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.687 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 20.0 mmt -73.59 97.17 2.57 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.87 -121.61 0.26 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.374 1.069 . . . . 0.0 108.514 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -85.25 54.46 3.11 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 122.717 1.246 . . . . 0.0 109.25 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.4 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 87.2 mt -127.79 -46.41 1.42 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.778 -176.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.71 21.7 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.426 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.687 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 49.0 t80 -122.58 75.85 1.29 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 121.965 0.888 . . . . 0.0 110.023 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.5 t70 179.55 135.74 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 113.506 -1.679 . . . . 0.0 107.16 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.3 p -52.03 -39.21 59.18 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.893 0.877 . . . . 0.0 113.118 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -68.09 -47.86 67.09 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.764 0.426 . . . . 0.0 110.677 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.47 -28.18 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 -176.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.9 t -74.75 -38.27 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.753 0.821 . . . . 0.0 109.86 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -68.07 -35.28 77.95 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.918 0.487 . . . . 0.0 110.525 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 10.5 tp10 -70.84 -42.92 69.53 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.388 0.675 . . . . 0.0 109.922 176.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 56' ' ' ALA . 56.0 tp -61.29 -48.43 81.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.305 1.042 . . . . 0.0 110.502 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 32.6 t -57.96 -47.64 82.33 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.134 0.974 . . . . 0.0 109.593 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 45.0 tp -53.29 -40.61 64.84 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.15 0.98 . . . . 0.0 111.22 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 71.9 mmtt -65.81 -55.11 18.85 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.566 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.454 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 97.7 mt -56.68 -32.14 65.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.082 0.953 . . . . 0.0 112.588 -173.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 66' ' ' SER . 45.7 mtm180 -59.75 -37.06 77.94 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.493 0.717 . . . . 0.0 111.044 178.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -93.91 -49.22 5.91 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.863 0.865 . . . . 0.0 111.239 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.59 -40.66 69.75 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.768 0.827 . . . . 0.0 111.83 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -125.5 -6.11 7.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.128 0.571 . . . . 0.0 111.909 -175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 75.78 3.6 73.96 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 113.609 0.204 . . . . 0.0 113.609 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.649 HG21 HG13 ' A' ' 95' ' ' VAL . 75.1 t -77.91 98.81 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.991 0.916 . . . . 0.0 109.679 -176.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 25.3 m -123.45 149.69 44.77 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.976 0.911 . . . . 0.0 110.168 -172.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.58 15.25 80.62 Favored Glycine 0 C--N 1.354 1.552 0 O-C-N 123.436 0.46 . . . . 0.0 113.827 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 15.9 m -92.05 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.166 0.986 . . . . 0.0 112.225 -173.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -54.42 -45.62 73.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.123 0.969 . . . . 0.0 111.938 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -65.5 -38.42 89.66 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 124.161 0.913 . . . . 0.0 110.982 -178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.472 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 5.1 mp0 -65.85 -40.38 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.248 1.019 . . . . 0.0 110.947 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.432 ' HA ' ' HG ' ' A' ' 85' ' ' LEU . 85.6 mt -76.01 -25.24 55.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 110.784 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.06 -28.34 62.26 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.061 0.944 . . . . 0.0 110.424 173.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -90.95 10.18 27.56 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.319 1.048 . . . . 0.0 112.35 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.613 HD13 ' HE3' ' A' ' 52' ' ' MET . 78.9 mt -79.53 126.99 31.58 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.89 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -126.73 -45.95 1.59 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.412 1.085 . . . . 0.0 108.083 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 35.5 p -115.61 154.86 28.68 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.816 0.817 . . . . 0.0 110.767 172.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.423 HG12 ' HE2' ' A' ' 92' ' ' PHE . 53.0 t -70.74 -36.82 66.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.115 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.71 -37.77 82.79 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.229 0.611 . . . . 0.0 110.56 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.27 -39.06 85.5 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 124.05 0.844 . . . . 0.0 110.854 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.434 HD13 HD11 ' A' ' 85' ' ' LEU . 44.3 tp -62.71 -42.36 99.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 123.401 0.438 . . . . 0.0 111.397 174.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.423 ' HE2' HG12 ' A' ' 88' ' ' VAL . 71.1 m-85 -59.57 -45.3 92.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.987 0.515 . . . . 0.0 110.638 175.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.15 -31.82 70.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.016 0.927 . . . . 0.0 111.445 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tt -70.22 -55.82 8.34 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.789 0.836 . . . . 0.0 109.653 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.649 HG13 HG21 ' A' ' 75' ' ' VAL . 59.6 t -64.49 -29.19 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 O-C-N 124.076 0.86 . . . . 0.0 110.15 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -61.53 -54.17 46.72 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.077 0.951 . . . . 0.0 110.175 173.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -69.41 -27.19 65.07 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.741 0.816 . . . . 0.0 111.308 -178.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -79.23 -32.29 43.88 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.927 0.891 . . . . 0.0 110.22 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -74.23 -41.09 61.91 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.475 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.47 97.29 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.706 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.106 0 C-N-CA 125.367 1.467 . . . . 0.0 112.295 178.355 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 119.411 -0.328 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.485 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 45.3 tt0 -73.16 -64.26 1.01 Allowed 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -171.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.07 -34.02 74.24 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.81 0.844 . . . . 0.0 110.115 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.6 t-160 -63.55 -42.8 98.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.094 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 91' ' ' LEU . 33.6 tp -74.36 -33.07 62.99 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.519 0.512 . . . . 0.0 110.959 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.6 -28.78 69.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.329 0.252 . . . . 0.0 110.874 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.3 m -72.41 -43.77 63.4 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.827 0.451 . . . . 0.0 110.297 172.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.6 t -54.87 -44.49 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.705 0.802 . . . . 0.0 110.567 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.12 -42.51 80.08 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.348 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.9 p -65.79 -34.74 78.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.729 0.299 . . . . 0.0 111.53 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.28 -36.79 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 C-N-CA 123.497 0.719 . . . . 0.0 110.83 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.32 -36.93 45.75 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.873 0.469 . . . . 0.0 112.038 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 m -87.23 -55.16 3.94 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.925 0.89 . . . . 0.0 110.33 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.5 -24.74 7.96 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.738 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.6 m -76.29 131.26 75.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 122.912 0.485 . . . . 0.0 110.041 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.479 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 25.5 Cg_endo -61.27 161.74 22.34 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.683 2.256 . . . . 0.0 112.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -59.39 -26.06 64.81 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 124.874 1.27 . . . . 0.0 112.467 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -68.38 -24.46 64.78 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.942 0.897 . . . . 0.0 111.369 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.479 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 12.9 mm-40 -85.92 -19.1 31.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.684 0.793 . . . . 0.0 110.92 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.3 mt -99.62 133.75 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.601 0.761 . . . . 0.0 110.33 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 t -121.86 168.55 11.73 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.861 0.864 . . . . 0.0 109.136 172.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -73.34 -20.55 60.76 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.926 0.491 . . . . 0.0 111.832 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.97 1.07 30.74 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.801 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.5 t -65.32 152.14 44.52 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.203 0.601 . . . . 0.0 111.942 -171.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -73.87 160.47 31.38 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.616 0.767 . . . . 0.0 110.606 175.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.676 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 17.4 mmt -104.9 26.67 8.92 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.063 0.945 . . . . 0.0 110.805 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.05 -61.65 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.165 0.507 . . . . 0.0 110.468 -170.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -94.07 -16.16 24.08 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.1 mp -85.61 -17.08 37.22 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.184 0.994 . . . . 0.0 112.278 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -156.42 -152.82 0.39 Allowed 'General case' 0 C--O 1.246 0.908 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 62.56 61.79 1.19 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.445 1.098 . . . . 0.0 112.125 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -177.03 137.52 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 113.197 -1.819 . . . . 0.0 106.918 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.7 m -56.47 -35.44 67.94 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.745 0.653 . . . . 0.0 111.752 -175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -81.48 -38.48 26.28 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.958 0.503 . . . . 0.0 110.822 -174.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.36 -39.71 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 121.372 0.606 . . . . 0.0 110.752 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.544 HG13 ' HB2' ' A' ' 82' ' ' LEU . 56.1 t -72.8 -31.3 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.567 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.5 t -69.03 -33.77 74.16 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.688 0.395 . . . . 0.0 110.309 173.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -70.49 -40.4 73.63 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.158 0.983 . . . . 0.0 110.035 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 38.6 tp -74.36 -35.21 63.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.946 0.899 . . . . 0.0 111.246 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.3 p -72.49 -40.78 66.63 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.845 0.458 . . . . 0.0 109.938 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.0 tp -58.3 -38.76 77.7 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 124.181 0.925 . . . . 0.0 110.466 171.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -64.03 -57.97 8.08 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.469 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.413 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 91.2 mt -62.16 -36.27 81.33 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.579 0.752 . . . . 0.0 111.471 -177.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -56.18 -42.73 77.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.827 1.251 . . . . 0.0 110.886 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -86.66 -32.65 20.42 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.261 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -90.42 -55.04 3.74 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.962 0.505 . . . . 0.0 111.786 -165.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -110.73 -1.83 16.5 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.847 0.859 . . . . 0.0 110.813 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.12 7.13 86.71 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.126 0.393 . . . . 0.0 113.245 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 42.4 t -81.92 95.02 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 123.597 0.759 . . . . 0.0 109.68 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.5 m -111.12 155.25 23.13 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.295 1.038 . . . . 0.0 111.322 -171.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.53 80.45 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 116.583 -0.28 . . . . 0.0 113.491 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 30.3 m -93.07 16.1 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.913 0.885 . . . . 0.0 111.551 -176.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -54.87 -52.48 62.69 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.139 0.975 . . . . 0.0 111.042 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -57.29 -42.91 82.6 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 24.1 mm-40 -60.55 -37.21 80.5 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.23 0.612 . . . . 0.0 111.421 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.544 ' HB2' HG13 ' A' ' 62' ' ' VAL . 87.3 mt -66.18 -35.29 80.06 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.956 0.902 . . . . 0.0 111.226 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -58.86 -43.0 90.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.698 172.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.7 -21.04 61.83 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 82.8 mt -76.76 126.78 31.56 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.53 0.332 . . . . 0.0 110.667 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -102.96 -26.75 12.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.525 0.73 . . . . 0.0 111.107 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 37.0 p -131.4 164.19 26.24 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.408 0.623 . . . . 0.0 111.263 -178.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 85.7 t -69.3 -36.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.016 -176.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.13 -29.27 68.14 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.977 0.511 . . . . 0.0 111.54 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HB3' HD22 ' A' ' 85' ' ' LEU . 47.1 mt-10 -66.5 -39.44 88.71 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.608 0.363 . . . . 0.0 110.476 171.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.499 ' HG ' HD21 ' A' ' 31' ' ' LEU . 37.5 tp -62.76 -42.78 99.84 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.983 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.1 m-85 -57.95 -58.24 9.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.436 0.694 . . . . 0.0 111.328 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -64.07 -24.88 67.87 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.443 0.464 . . . . 0.0 111.533 -176.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.6 tp -69.94 -50.04 45.92 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.293 0.371 . . . . 0.0 110.305 175.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 89.6 t -58.58 -44.99 90.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.056 0.542 . . . . 0.0 110.326 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -67.44 -46.74 72.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.83 0.852 . . . . 0.0 111.895 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -63.23 -56.13 19.11 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.495 0.718 . . . . 0.0 110.589 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -65.95 -22.27 66.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.367 1.067 . . . . 0.0 112.0 -175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -68.94 -56.95 6.26 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.266 0.626 . . . . 0.0 110.261 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -88.35 -62.41 1.5 Allowed 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.348 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.618 0 C-N-CA 123.6 0.76 . . . . 0.0 110.027 179.589 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.6 tmm? . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.38 -41.44 89.38 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.612 0.765 . . . . 0.0 111.349 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -74.22 -29.91 61.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.947 1.299 . . . . 0.0 110.814 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.426 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.1 t60 -70.79 -48.72 52.72 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.702 0.801 . . . . 0.0 109.792 -178.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.524 HD23 ' HG ' ' A' ' 91' ' ' LEU . 8.1 mp -62.62 -35.98 81.29 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.265 0.978 . . . . 0.0 110.384 175.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -61.19 -39.5 90.4 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.915 0.886 . . . . 0.0 110.905 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.4 m -70.23 -39.76 74.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.896 0.878 . . . . 0.0 110.977 175.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.513 HG13 ' HG2' ' A' ' 68' ' ' LYS . 64.5 t -59.77 -48.41 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.367 0.667 . . . . 0.0 110.553 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.32 -31.5 71.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.722 0.809 . . . . 0.0 111.256 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 t -61.72 -43.21 99.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.306 0.642 . . . . 0.0 111.356 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.6 t -79.07 -46.03 23.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.036 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.5 -43.27 73.46 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.852 0.861 . . . . 0.0 112.085 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 m -91.8 -15.35 28.38 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.156 0.582 . . . . 0.0 111.617 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.12 21.5 70.51 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 114.239 0.455 . . . . 0.0 114.239 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.47 152.76 42.91 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 124.245 1.018 . . . . 0.0 110.442 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.76 151.92 45.19 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.506 2.137 . . . . 0.0 112.384 165.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.75 -26.41 68.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.756 0.822 . . . . 0.0 111.32 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -75.28 -19.98 59.39 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.138 0.975 . . . . 0.0 111.573 -176.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.59 -36.59 73.64 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.551 0.691 . . . . 0.0 109.487 176.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG23 HG21 ' A' ' 88' ' ' VAL . 47.9 mt -91.18 89.65 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.827 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -94.18 26.49 3.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.715 0.806 . . . . 0.0 110.669 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.16 -48.17 0.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.136 1.774 . . . . 0.0 110.302 -168.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.28 82.35 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.595 0.758 . . . . 0.0 109.683 164.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB2' HG21 ' A' ' 88' ' ' VAL . 48.8 m -160.57 153.76 21.74 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.548 1.139 . . . . 0.0 109.127 -177.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -101.58 135.95 42.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.058 0.943 . . . . 0.0 109.953 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.526 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 71.9 mmm -81.54 6.41 14.96 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.963 0.505 . . . . 0.0 111.644 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.81 -30.95 71.17 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.491 0.716 . . . . 0.0 111.265 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.44 -43.67 6.81 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.401 167.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 62.2 mt -75.97 -11.5 59.97 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.526 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -169.36 13.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -108.3 -20.14 13.24 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 118.477 0.581 . . . . 0.0 112.341 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.428 ' O ' HG23 ' A' ' 62' ' ' VAL . 24.3 t70 -70.68 135.47 48.35 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 m -54.38 -35.84 63.26 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -172.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.45 -41.12 73.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.27 -35.89 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 123.866 0.729 . . . . 0.0 111.286 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 58' ' ' ASP . 62.4 t -64.06 -44.9 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.7 t -69.24 -37.82 78.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.922 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.93 -35.34 64.59 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.788 0.835 . . . . 0.0 110.796 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.15 -41.39 63.98 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.183 0.993 . . . . 0.0 109.527 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.3 t -60.23 -43.57 95.94 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.709 0.803 . . . . 0.0 109.835 173.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.72 -40.47 95.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.801 1.24 . . . . 0.0 110.639 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.513 ' HG2' HG13 ' A' ' 34' ' ' VAL . 6.7 tppt? -72.39 -56.58 5.22 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.246 -171.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.568 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 87.2 mt -57.99 -34.47 70.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.542 0.737 . . . . 0.0 111.261 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG3' ' HB ' ' A' ' 76' ' ' THR . 72.0 ttt180 -59.04 -34.9 72.46 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.07 1.348 . . . . 0.0 112.222 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -94.32 -58.39 2.23 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 122.953 0.501 . . . . 0.0 110.342 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -54.02 -44.43 70.94 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.663 1.185 . . . . 0.0 112.31 -176.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -118.75 -27.22 5.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.25 0.62 . . . . 0.0 112.162 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.8 7.08 64.91 Favored Glycine 0 N--CA 1.471 1.023 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.568 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 99.0 t -75.85 90.36 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.045 0 C-N-CA 124.153 0.981 . . . . 0.0 109.44 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.445 ' HB ' ' HG3' ' A' ' 70' ' ' ARG . 11.4 t -115.2 163.87 15.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.134 0.974 . . . . 0.0 111.069 -174.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 21.71 65.28 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.701 -0.682 . . . . 0.0 113.359 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 20.6 m -97.97 13.64 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.955 0.902 . . . . 0.0 111.646 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -48.85 -51.01 31.94 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.415 1.486 . . . . 0.0 112.373 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.51 -50.53 72.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.963 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.67 -30.34 71.31 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.29 -177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.6 mt -70.47 -36.18 73.73 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.257 0.623 . . . . 0.0 110.244 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -74.59 -23.96 58.82 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.135 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.79 -13.21 59.93 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.985 0.514 . . . . 0.0 111.752 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 80.3 mt -70.74 158.76 35.72 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.715 0.406 . . . . 0.0 110.734 176.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -136.57 -42.53 0.61 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.05 0.54 . . . . 0.0 110.103 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.422 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 74.9 p -115.71 159.44 21.39 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.315 0.646 . . . . 0.0 111.084 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.459 HG21 HG23 ' A' ' 46' ' ' ILE . 69.0 t -59.21 -36.69 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.137 177.045 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.405 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 8.0 m-20 -58.52 -35.71 72.7 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.458 176.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.422 ' HG2' ' OG1' ' A' ' 87' ' ' THR . 37.0 mm-40 -70.52 -37.3 74.09 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.251 0.621 . . . . 0.0 111.743 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.524 ' HG ' HD23 ' A' ' 31' ' ' LEU . 65.7 tp -61.88 -42.53 99.18 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 121.149 0.5 . . . . 0.0 110.607 173.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -63.06 -38.19 90.19 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.436 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 86.8 mm-40 -64.98 -48.27 74.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.913 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.4 tt -53.15 -61.06 2.54 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.532 1.133 . . . . 0.0 110.161 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.473 HG11 HD11 ' A' ' 31' ' ' LEU . 43.7 t -68.63 -31.62 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.236 -173.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.659 ' HG3' HH21 ' A' ' 99' ' ' ARG . 40.3 tt0 -61.05 -45.17 95.87 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.24 0.616 . . . . 0.0 111.086 174.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 74.1 mmtt -67.98 -46.26 71.85 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.869 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -70.06 -24.63 63.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.879 0.471 . . . . 0.0 111.551 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.659 HH21 ' HG3' ' A' ' 96' ' ' GLU . 18.5 ttp180 -66.84 -44.49 80.94 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.856 0.862 . . . . 0.0 109.853 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -89.54 -0.41 57.49 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.61 0.764 . . . . 0.0 111.94 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.032 0 C-N-CA 125.297 1.439 . . . . 0.0 111.412 -179.471 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 120.789 0.328 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.418 ' HA ' HD23 ' A' ' 31' ' ' LEU . 39.1 mt-10 -65.52 -32.67 74.39 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.141 0.976 . . . . 0.0 111.143 -175.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.03 -47.44 71.57 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 124.398 1.061 . . . . 0.0 110.793 172.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 34' ' ' VAL . 7.7 m-70 -72.77 -26.65 61.62 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.437 -175.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.429 HD11 HG21 ' A' ' 95' ' ' VAL . 3.5 mm? -60.79 -45.52 94.09 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.731 0.696 . . . . 0.0 109.314 168.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 5.9 mp -66.11 -36.31 82.83 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.478 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -68.25 -42.31 79.84 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.576 0.75 . . . . 0.0 110.682 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.545 HG13 ' HD2' ' A' ' 68' ' ' LYS . 61.3 t -61.13 -49.83 83.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.857 0.463 . . . . 0.0 110.505 178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 90.8 mt -66.74 -39.17 87.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.928 0.767 . . . . 0.0 112.291 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.9 p -65.52 -45.2 84.44 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.154 0.582 . . . . 0.0 111.59 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.0 t -71.13 -30.49 41.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 114.68 -1.145 . . . . 0.0 110.3 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.62 -37.24 62.87 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.061 0.544 . . . . 0.0 112.203 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.494 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 80.7 p -95.01 -60.95 1.57 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.183 0.593 . . . . 0.0 110.993 -173.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.5 -30.95 2.27 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.003 -177.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -72.12 141.3 83.68 Favored Pre-proline 0 C--N 1.356 0.854 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.899 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.552 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 19.3 Cg_endo -59.47 152.59 60.42 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.457 2.105 . . . . 0.0 112.307 176.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.471 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 13.7 ptmm? -60.78 -20.3 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.426 1.09 . . . . 0.0 112.316 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.63 -35.64 80.67 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.839 0.855 . . . . 0.0 111.32 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.552 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 20.3 mm-40 -75.94 -11.97 60.06 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.684 0.794 . . . . 0.0 111.942 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.447 ' HB ' ' HG ' ' A' ' 32' ' ' LEU . 23.7 mt -98.17 123.12 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 123.056 0.542 . . . . 0.0 110.478 -176.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.7 p -136.1 179.33 6.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.416 1.486 . . . . 0.0 107.692 172.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 89' ' ' ASP . 8.4 ptm180 -52.17 -56.36 15.06 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 123.558 0.743 . . . . 0.0 112.566 177.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -94.61 17.66 12.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.631 -0.668 . . . . 0.0 111.919 -175.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.0 t -70.55 -13.31 62.05 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.079 0.552 . . . . 0.0 111.165 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.448 ' HD3' HG23 ' A' ' 87' ' ' THR . 26.7 mmt180 71.51 177.06 0.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.145 1.378 . . . . 0.0 111.44 175.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.504 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 34.4 mtt -129.44 29.0 5.14 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.654 0.782 . . . . 0.0 111.401 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -56.78 -40.57 76.11 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.595 0.758 . . . . 0.0 110.659 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.03 -23.92 7.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.238 1.015 . . . . 0.0 110.597 174.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 5.0 mp -77.2 -30.17 54.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.682 0.793 . . . . 0.0 112.82 -166.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -166.03 89.18 0.4 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.4 0.68 . . . . 0.0 110.499 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -160.22 -33.65 0.06 Allowed 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.942 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -63.92 147.42 52.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.958 0.903 . . . . 0.0 111.424 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -55.76 -44.88 78.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.852 0.861 . . . . 0.0 112.422 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.3 tp -68.68 -39.28 80.63 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.732 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.519 HG13 ' HB1' ' A' ' 38' ' ' ALA . 81.0 t -65.8 -48.91 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 78.4 t -68.32 -38.82 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.753 0.821 . . . . 0.0 111.439 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 68.4 p -61.96 -55.66 27.13 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -61.65 -27.46 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.626 0.77 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 41.6 tp -64.26 -49.05 73.4 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.149 0.979 . . . . 0.0 109.852 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 85.2 p -68.24 -34.75 76.79 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.568 0.347 . . . . 0.0 111.26 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 63' ' ' SER . 85.1 mt -68.67 -33.09 73.39 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.703 0.801 . . . . 0.0 111.788 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' HG13 ' A' ' 34' ' ' VAL . 29.4 ttmt -85.5 -43.72 13.32 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.804 -175.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 94.3 mt -61.25 -27.9 68.78 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.534 0.734 . . . . 0.0 110.766 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -57.69 -40.2 78.91 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.575 1.15 . . . . 0.0 111.065 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -85.48 -45.77 11.5 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.19 0.596 . . . . 0.0 111.105 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.78 -51.96 35.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.129 0.972 . . . . 0.0 111.878 -170.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -123.51 -4.46 8.26 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.311 0.644 . . . . 0.0 112.176 -173.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.72 12.8 84.12 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-O 120.182 -0.232 . . . . 0.0 113.288 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.476 HG12 HG21 ' A' ' 78' ' ' VAL . 57.3 t -86.79 107.13 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.861 0.865 . . . . 0.0 109.406 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 m -136.89 156.33 48.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.447 1.099 . . . . 0.0 109.597 -171.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.04 35.25 90.36 Favored Glycine 0 C--N 1.354 1.549 0 O-C-N 123.672 0.607 . . . . 0.0 111.996 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 75' ' ' VAL . 20.5 m -119.62 4.21 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.387 1.075 . . . . 0.0 110.704 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 82' ' ' LEU . 7.1 p-10 -55.83 -37.94 69.38 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.496 1.119 . . . . 0.0 112.656 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.55 -50.93 71.99 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.789 0.681 . . . . 0.0 110.744 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.76 -23.52 64.33 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.921 -178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 79' ' ' ASP . 87.7 mt -73.27 -31.26 63.96 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.551 0.741 . . . . 0.0 111.19 175.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.21 -37.37 85.39 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.522 0.514 . . . . 0.0 109.774 171.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.99 -0.26 30.39 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.014 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 94' ' ' LEU . 79.6 mt -82.17 144.24 30.87 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 169.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.36 -8.44 2.56 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.992 0.917 . . . . 0.0 110.38 174.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.448 HG23 ' HD3' ' A' ' 51' ' ' ARG . 4.2 m -138.96 147.1 41.79 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.97 -31.91 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.676 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 38.2 t70 -56.79 -40.62 76.23 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.816 0.846 . . . . 0.0 110.059 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.71 -29.57 64.7 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.979 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.479 ' HB2' ' HE3' ' A' ' 52' ' ' MET . 67.1 tp -64.19 -45.52 87.98 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.218 0.607 . . . . 0.0 111.162 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -58.64 -45.55 89.06 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.682 0.614 . . . . 0.0 109.653 177.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 19.0 mm100 -61.78 -38.59 88.64 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.293 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -62.68 -61.79 2.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.042 0.937 . . . . 0.0 110.207 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.456 HG13 HG21 ' A' ' 75' ' ' VAL . 92.5 t -60.6 -44.53 97.02 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.129 -172.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -66.45 -35.62 80.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -67.36 -38.06 84.19 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.693 0.224 . . . . 0.0 111.475 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -84.34 -17.67 38.71 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.008 0.523 . . . . 0.0 111.981 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -82.3 -48.46 11.17 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.52 37.29 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.61 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.178 0 C-N-CA 124.685 1.194 . . . . 0.0 111.09 -177.603 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.6 ptm . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.2 -56.13 16.87 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.36 -35.53 80.59 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.034 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -70.5 -51.66 27.39 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.955 0.902 . . . . 0.0 110.742 -169.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HA ' HG12 ' A' ' 34' ' ' VAL . 4.1 mm? -66.95 -33.76 76.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.331 0.395 . . . . 0.0 110.154 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.5 -32.79 74.58 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 110.588 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' HG23 ' A' ' 37' ' ' VAL . 97.8 m -71.93 -51.32 22.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.427 0.691 . . . . 0.0 111.018 178.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' A' ' 31' ' ' LEU . 13.3 p -62.46 -31.65 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 122.208 0.203 . . . . 0.0 110.819 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.539 HD11 HD23 ' A' ' 91' ' ' LEU . 87.1 mt -73.16 -34.2 65.9 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.252 0.621 . . . . 0.0 111.439 173.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.6 t -64.64 -36.6 84.77 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.371 0.668 . . . . 0.0 111.12 177.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 33' ' ' THR . 22.0 t -82.77 -25.29 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.517 0.727 . . . . 0.0 110.224 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.56 -43.71 54.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.45 0.7 . . . . 0.0 111.453 178.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.8 p -86.94 -50.39 6.71 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.758 0.823 . . . . 0.0 110.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 122.78 -33.04 4.23 Favored Glycine 0 C--N 1.341 0.817 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.007 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.1 m -73.43 130.17 84.54 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 123.006 0.522 . . . . 0.0 111.124 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -54.77 157.53 12.52 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.397 2.731 . . . . 0.0 114.151 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -56.85 -27.4 60.24 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.358 1.063 . . . . 0.0 112.463 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -68.17 -21.37 64.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.757 0.823 . . . . 0.0 111.801 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -105.33 2.98 29.36 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.541 0.737 . . . . 0.0 111.545 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -113.04 120.91 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.293 0.637 . . . . 0.0 109.307 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.6 m -100.85 167.31 10.36 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.318 0.647 . . . . 0.0 109.302 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -71.29 -19.41 62.34 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.836 0.35 . . . . 0.0 110.757 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -123.23 79.23 1.65 Allowed 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.4 m -125.08 20.27 8.26 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.549 1.14 . . . . 0.0 108.929 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 56.08 -169.84 0.09 Allowed 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 112.312 -170.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 49.8 ttm -147.24 84.8 1.58 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.577 0.703 . . . . 0.0 109.254 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.36 -4.13 8.37 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.608 174.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -137.18 -36.41 0.66 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.333 0.653 . . . . 0.0 110.63 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 69.6 mt -66.64 -36.85 83.56 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -167.65 79.81 0.18 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.526 0.73 . . . . 0.0 110.142 177.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -147.76 -15.79 0.37 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.468 0.307 . . . . 0.0 111.327 -175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -91.7 150.22 21.24 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.719 0.808 . . . . 0.0 109.338 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -54.04 -45.86 71.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.92 0.888 . . . . 0.0 112.616 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.05 -36.1 74.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.716 0.407 . . . . 0.0 110.551 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.509 HG13 ' HB1' ' A' ' 38' ' ' ALA . 38.4 t -71.3 -40.35 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.214 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 51.3 t -69.81 -39.8 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.915 0.886 . . . . 0.0 110.291 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.488 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 41.5 t -64.37 -46.31 83.92 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.634 0.584 . . . . 0.0 110.264 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -62.19 -43.43 98.86 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.975 0.797 . . . . 0.0 110.563 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.57 -49.34 72.98 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.929 173.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.9 t -65.64 -22.79 66.69 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.159 0.984 . . . . 0.0 112.081 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 63' ' ' SER . 91.1 mt -67.61 -52.12 42.21 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -26.12 61.26 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.36 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.598 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 30.8 mt -67.79 -46.26 72.5 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 174.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -63.28 -42.24 99.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.023 0.929 . . . . 0.0 110.515 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -69.64 -46.4 66.25 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.51 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.33 -49.53 4.22 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.82 -168.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -97.75 -11.64 23.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.377 0.671 . . . . 0.0 111.982 -174.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.02 8.66 86.92 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 123.328 0.392 . . . . 0.0 113.968 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 46.2 t -86.46 108.21 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.35 0.66 . . . . 0.0 110.529 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.0 t -150.31 167.24 27.6 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.99 0.916 . . . . 0.0 109.756 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 24.32 75.14 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 112.046 -0.422 . . . . 0.0 112.046 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 31.6 m -126.09 18.19 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.431 1.092 . . . . 0.0 110.965 -172.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -51.85 -40.92 61.36 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.586 1.154 . . . . 0.0 113.2 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -70.1 -39.41 75.53 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.009 0.924 . . . . 0.0 110.681 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.26 -33.08 71.18 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.394 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.94 -29.84 62.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.715 0.806 . . . . 0.0 111.094 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -73.05 -32.54 65.12 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.969 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.41 -17.86 61.77 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.637 0.775 . . . . 0.0 110.632 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.04 132.96 55.05 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.218 0.607 . . . . 0.0 111.849 177.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.26 -6.55 5.37 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.985 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.6 p -139.94 154.35 47.19 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.412 0.625 . . . . 0.0 111.398 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.4 t -68.58 -40.81 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.771 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.479 ' HA ' ' HD2' ' A' ' 92' ' ' PHE . 9.4 t70 -64.94 -30.21 71.19 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.755 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.26 -41.38 81.16 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.259 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.539 HD23 HD11 ' A' ' 35' ' ' LEU . 59.6 tp -62.63 -42.08 99.39 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 123.464 0.477 . . . . 0.0 111.036 175.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.479 ' HD2' ' HA ' ' A' ' 89' ' ' ASP . 27.0 m-85 -54.57 -48.77 71.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.868 0.467 . . . . 0.0 110.525 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 79.7 mt-30 -68.96 -37.79 79.03 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.555 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.8 tt -57.46 -55.88 29.04 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.904 0.882 . . . . 0.0 110.2 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.9 t -61.26 -42.55 93.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.491 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -56.67 -42.44 79.01 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.266 0.979 . . . . 0.0 110.771 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 33.4 mmtp -66.64 -47.29 73.04 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.687 0.395 . . . . 0.0 111.737 -178.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -74.96 -18.43 60.39 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.976 0.51 . . . . 0.0 112.043 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -82.64 -55.41 4.47 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.539 0.736 . . . . 0.0 109.955 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.31 -26.69 62.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.751 0.82 . . . . 0.0 111.594 -176.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.651 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 170.792 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 23.1 ptm . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.46 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 42.9 mt-10 -59.05 -57.15 14.35 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.491 0.716 . . . . 0.0 112.767 -167.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.68 -25.29 67.88 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.984 0.803 . . . . 0.0 111.816 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.1 m80 -67.93 -45.41 74.4 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.64 0.587 . . . . 0.0 110.287 171.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 7.4 mp -67.26 -28.93 68.44 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.544 0.337 . . . . 0.0 111.495 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.536 ' HA ' HG21 ' A' ' 46' ' ' ILE . 8.4 mp -63.24 -38.7 92.18 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.696 0.399 . . . . 0.0 109.991 172.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -73.99 -34.11 64.07 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.086 0.866 . . . . 0.0 110.656 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.4 t -63.06 -58.06 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.141 0.576 . . . . 0.0 110.2 178.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.42 -40.77 97.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.548 0.739 . . . . 0.0 111.455 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.9 p -63.2 -56.9 12.8 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.467 0.479 . . . . 0.0 111.32 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.1 t -67.44 -41.38 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 C-N-CA 123.336 0.654 . . . . 0.0 111.271 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.69 -28.2 68.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.208 0.603 . . . . 0.0 112.145 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.9 m -92.9 -25.63 17.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.968 0.507 . . . . 0.0 111.394 177.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.88 17.15 58.53 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 123.001 0.334 . . . . 0.0 112.915 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.4 m -102.11 160.76 25.46 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 124.617 1.167 . . . . 0.0 109.945 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -70.23 158.67 55.62 Favored 'Trans proline' 0 C--N 1.368 1.595 0 C-N-CA 122.323 2.015 . . . . 0.0 112.692 168.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -64.76 -20.01 66.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.81 0.844 . . . . 0.0 111.182 173.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.94 -31.52 65.05 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.286 1.034 . . . . 0.0 110.97 173.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -96.4 15.84 20.2 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.99 0.916 . . . . 0.0 111.104 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.536 HG21 ' HA ' ' A' ' 32' ' ' LEU . 21.1 mm -123.46 141.11 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.69 0.796 . . . . 0.0 109.621 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 p -155.43 -168.6 2.88 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.173 0.989 . . . . 0.0 109.706 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.465 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 62.0 mtp85 -75.18 -9.09 58.23 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 176.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -162.71 92.93 0.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 161.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.7 t -106.27 14.13 27.89 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.191 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.685 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 44.8 mmt-85 60.84 104.5 0.02 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 124.37 1.068 . . . . 0.0 111.757 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.49 ' SD ' HD22 ' A' ' 91' ' ' LEU . 71.4 mtm -74.38 -2.16 24.13 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.936 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.685 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 12.7 pt-20 -61.06 -31.41 71.06 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.144 0.578 . . . . 0.0 110.908 173.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -87.51 -39.53 15.09 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.766 0.826 . . . . 0.0 109.986 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.9 mt -81.87 -86.49 0.1 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.724 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -104.44 80.37 1.68 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.497 0.719 . . . . 0.0 110.199 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -145.0 -11.05 0.57 Allowed 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.809 -177.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.45 148.02 26.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -53.8 -40.23 66.16 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.164 0.985 . . . . 0.0 112.638 -174.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -74.39 -39.03 62.94 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.09 0.556 . . . . 0.0 110.708 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 22.7 t -70.9 -37.23 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 116.795 -0.184 . . . . 0.0 110.983 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.4 t -68.62 -34.03 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 123.583 0.753 . . . . 0.0 110.011 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.1 t -67.22 -42.15 84.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.876 0.47 . . . . 0.0 110.73 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.86 -23.09 52.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.084 0.954 . . . . 0.0 111.643 177.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.13 -50.28 42.16 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 173.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.5 t -60.96 -41.96 97.35 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.48 1.112 . . . . 0.0 110.772 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.0 tp -57.93 -48.87 78.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.539 1.136 . . . . 0.0 110.715 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -68.33 -40.85 81.48 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.141 0.976 . . . . 0.0 111.073 -175.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.42 ' HA ' ' HD1' ' A' ' 73' ' ' PHE . 90.1 mt -65.13 -41.57 94.71 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.499 0.72 . . . . 0.0 110.591 179.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -70.59 -34.69 72.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.67 0.788 . . . . 0.0 111.121 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -77.78 -62.74 1.57 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.963 0.505 . . . . 0.0 111.461 -172.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.15 -50.89 17.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.911 0.485 . . . . 0.0 111.836 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' A' ' 69' ' ' LEU . 32.8 m-85 -91.92 -31.02 15.81 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.256 0.623 . . . . 0.0 111.689 -168.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.79 5.79 80.78 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.741 -173.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.632 HG21 HG13 ' A' ' 95' ' ' VAL . 88.3 t -77.11 87.68 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 122.106 0.955 . . . . 0.0 109.638 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.0 m -101.68 162.06 13.19 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 114.063 -1.426 . . . . 0.0 109.928 -177.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.84 38.85 93.26 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 123.503 0.502 . . . . 0.0 113.094 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.481 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 17.4 m -113.89 5.16 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.971 0.909 . . . . 0.0 111.443 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.59 -46.18 84.33 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.855 1.262 . . . . 0.0 112.723 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.48 -37.74 87.72 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.483 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.551 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 7.6 mp0 -66.69 -40.46 88.54 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.615 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 85.3 mt -59.98 -37.13 78.72 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.568 0.747 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.53 -38.63 87.57 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.059 174.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.03 -20.7 59.47 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.26 0.624 . . . . 0.0 111.719 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 95.5 mt -84.09 154.02 23.43 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.443 0.697 . . . . 0.0 112.066 -176.492 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.521 ' HG3' HG23 ' A' ' 87' ' ' THR . 9.3 pt-20 -136.48 -37.61 0.69 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 109.196 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HG3' ' A' ' 86' ' ' GLU . 11.9 p -102.56 143.28 32.46 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 125.675 1.59 . . . . 0.0 110.538 -173.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.3 t -77.81 -25.81 14.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.173 -173.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -64.81 -39.88 94.3 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.569 0.699 . . . . 0.0 109.854 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.489 ' HB3' HD22 ' A' ' 85' ' ' LEU . 3.9 mp0 -65.47 -36.27 83.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.921 173.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.49 HD22 ' SD ' ' A' ' 52' ' ' MET . 63.7 tp -66.4 -35.25 79.86 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.998 0.519 . . . . 0.0 111.397 172.028 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.465 ' HE2' ' HA ' ' A' ' 48' ' ' ARG . 21.5 m-85 -66.16 -51.73 55.05 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.285 0.634 . . . . 0.0 110.506 178.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.443 ' O ' ' HB2' ' A' ' 97' ' ' LYS . 4.3 pt20 -70.08 -18.51 63.26 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.566 0.347 . . . . 0.0 111.513 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 85' ' ' LEU . 64.9 tp -68.99 -47.7 64.92 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.962 0.505 . . . . 0.0 110.614 171.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.632 HG13 HG21 ' A' ' 75' ' ' VAL . 75.9 t -64.56 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.53 0.732 . . . . 0.0 110.229 176.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 93' ' ' GLN . 33.1 tt0 -60.94 -40.8 94.68 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.543 1.137 . . . . 0.0 110.688 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 6.6 tmtt? -63.58 -44.04 95.2 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.301 1.04 . . . . 0.0 109.71 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.8 -24.28 52.81 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.45 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -86.98 -39.05 16.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 123.339 0.399 . . . . 0.0 110.985 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.69 -56.64 4.26 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.461 0.704 . . . . 0.0 109.917 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 172.415 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 44.4 mt-10 -62.71 -56.84 14.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.697 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -58.82 -37.24 75.96 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 124.518 1.136 . . . . 0.0 111.752 -173.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -67.94 -45.45 74.25 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.275 0.63 . . . . 0.0 111.141 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -70.14 -28.62 65.51 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 35' ' ' LEU . 9.4 tp -73.82 -27.04 60.91 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.269 1.028 . . . . 0.0 109.903 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 m -70.32 -42.38 72.0 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.741 0.816 . . . . 0.0 109.606 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.54 -42.95 77.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.313 0.645 . . . . 0.0 110.525 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 32' ' ' LEU . 90.1 mt -67.58 -39.67 84.84 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.11 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 76.4 p -71.6 -29.33 64.57 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.843 0.457 . . . . 0.0 111.191 -176.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -75.15 -40.07 43.77 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 C-N-CA 123.063 0.545 . . . . 0.0 110.312 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.44 -35.55 75.78 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.747 0.819 . . . . 0.0 112.023 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 78.1 p -91.81 -55.6 3.41 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.267 0.627 . . . . 0.0 110.766 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.61 -26.85 5.88 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.072 -175.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.67 148.75 66.34 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.347 0.659 . . . . 0.0 110.408 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.475 ' HD2' ' HG3' ' A' ' 45' ' ' GLU . 76.7 Cg_exo -53.55 159.21 6.73 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 123.396 2.731 . . . . 0.0 113.99 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 8.8 mtmp? -60.42 -36.42 78.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.986 0.914 . . . . 0.0 110.692 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.02 -8.75 57.97 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.057 0.943 . . . . 0.0 112.046 -177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.475 ' HG3' ' HD2' ' A' ' 42' ' ' PRO . 34.6 mm-40 -90.89 -3.79 57.06 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.647 0.779 . . . . 0.0 110.743 170.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.4 mt -115.45 138.71 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.157 0.983 . . . . 0.0 109.323 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -133.77 161.98 33.23 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.007 0.923 . . . . 0.0 108.667 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.71 -34.6 78.21 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.8 -20.16 60.97 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.926 1.291 . . . . 0.0 112.445 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -74.05 155.99 37.95 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.263 1.025 . . . . 0.0 111.429 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -91.87 176.47 6.51 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.622 0.769 . . . . 0.0 110.326 173.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 55.3 mtt -110.58 111.97 23.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.687 0.795 . . . . 0.0 110.639 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -135.51 -53.33 0.77 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 174.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.95 -38.07 9.14 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.072 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 39' ' ' SER . 56.5 mt -66.28 -43.14 87.21 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.552 -170.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.55 84.95 0.17 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.976 0.798 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -152.56 -48.23 0.1 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.319 0.248 . . . . 0.0 110.54 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 61' ' ' VAL . 18.3 t70 -62.92 144.14 57.03 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.56 0.538 . . . . 0.0 110.048 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.7 p -55.7 -44.74 77.67 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 111.702 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.88 -40.03 94.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.688 0.795 . . . . 0.0 111.087 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 58' ' ' ASP . 93.1 t -62.81 -43.5 98.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.03 0.532 . . . . 0.0 110.724 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.67 -30.83 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.031 0.933 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.0 m -66.46 -42.73 87.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.479 0.712 . . . . 0.0 110.108 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.41 -32.56 64.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.163 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.92 -46.18 82.74 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 0.0 110.317 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.0 p -70.61 -30.45 67.11 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.689 0.796 . . . . 0.0 111.028 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.54 -39.11 85.01 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.713 0.805 . . . . 0.0 109.619 173.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 5.9 mptp? -66.49 -44.12 83.53 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 123.521 0.728 . . . . 0.0 109.515 174.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.3 mt -64.0 -27.03 68.84 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.357 0.411 . . . . 0.0 111.259 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -49.49 77.62 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.434 0.693 . . . . 0.0 110.147 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -72.21 -43.39 64.53 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.377 -175.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 15.1 mm-40 -82.61 -52.32 6.92 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.693 0.797 . . . . 0.0 111.102 -168.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -126.31 0.57 7.04 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -171.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 70.47 6.47 58.39 Favored Glycine 0 N--CA 1.478 1.489 0 CA-C-O 119.777 -0.457 . . . . 0.0 114.031 -177.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 90.6 t -80.4 124.2 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.161 0.984 . . . . 0.0 110.674 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.2 m -149.0 155.72 41.21 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.715 0.806 . . . . 0.0 109.798 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.43 -18.2 57.47 Favored Glycine 0 C--N 1.348 1.223 0 CA-C-N 116.421 -0.354 . . . . 0.0 112.518 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.1 m -79.84 8.42 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 124.543 1.137 . . . . 0.0 112.144 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.35 -40.39 61.9 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.745 1.218 . . . . 0.0 112.145 -176.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.04 -46.3 81.87 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.978 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -68.66 -28.58 67.01 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.042 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.59 -37.8 77.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.103 0.961 . . . . 0.0 109.806 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.44 -32.25 73.79 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.255 174.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -79.18 -16.45 56.58 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.1 mt -70.75 138.45 50.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.586 0.354 . . . . 0.0 110.205 175.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -125.79 -11.53 6.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.531 0.732 . . . . 0.0 109.581 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.408 ' HB ' ' HG3' ' A' ' 90' ' ' GLU . 2.0 m -135.9 146.91 47.88 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 123.081 0.552 . . . . 0.0 109.979 -175.02 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.39 -30.32 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.267 -174.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -52.5 -49.12 65.39 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 123.48 0.488 . . . . 0.0 110.459 170.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HB ' ' A' ' 87' ' ' THR . 47.4 mt-10 -61.16 -40.15 92.78 Favored 'General case' 0 C--N 1.35 0.6 0 O-C-N 124.499 1.124 . . . . 0.0 110.877 -176.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.73 -48.66 78.25 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.707 0.63 . . . . 0.0 111.785 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.435 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 9.3 m-85 -58.18 -39.1 78.04 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.485 0.49 . . . . 0.0 110.693 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -77.31 -31.83 54.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.662 0.601 . . . . 0.0 111.46 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.31 -55.38 8.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.18 0.592 . . . . 0.0 109.925 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.3 -43.92 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.482 1.113 . . . . 0.0 110.634 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -63.54 -40.93 98.29 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.973 0.796 . . . . 0.0 111.289 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.85 -29.39 66.62 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.201 0.6 . . . . 0.0 111.083 -177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -78.4 -36.97 45.07 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.626 0.77 . . . . 0.0 110.959 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.88 -37.42 55.55 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.512 1.125 . . . . 0.0 110.868 -176.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.76 -46.35 11.49 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.551 0.74 . . . . 0.0 109.902 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.222 0 C-N-CA 124.754 1.222 . . . . 0.0 112.305 175.487 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 CA-C-O 120.287 0.089 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -61.74 -40.03 93.65 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.29 0.994 . . . . 0.0 110.918 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.4 -43.09 95.49 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.6 m-70 -69.03 -37.06 78.41 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.638 0.775 . . . . 0.0 110.801 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.2 tp -71.25 -39.39 71.64 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.289 0.636 . . . . 0.0 111.071 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 9.2 mp -69.0 -32.48 72.06 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.843 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.7 m -70.58 -34.35 72.09 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.696 0.399 . . . . 0.0 110.713 173.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 68' ' ' LYS . 20.4 t -56.83 -46.87 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.361 0.664 . . . . 0.0 109.772 172.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -68.3 -36.68 79.71 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.962 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.3 p -68.33 -36.16 78.86 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.826 0.45 . . . . 0.0 111.751 -176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.3 -27.63 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.261 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.37 -41.72 63.06 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.162 0.585 . . . . 0.0 111.341 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.3 p -91.2 -63.07 1.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.468 0.707 . . . . 0.0 111.137 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.55 -38.58 1.56 Allowed Glycine 0 C--N 1.343 0.971 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -68.37 141.91 94.01 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.347 0.659 . . . . 0.0 110.368 175.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.441 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 56.6 Cg_endo -67.08 158.16 58.19 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.795 2.33 . . . . 0.0 111.639 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.745 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 20.5 pttm -68.15 -18.41 64.61 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.24 -31.11 65.2 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 124.226 1.011 . . . . 0.0 111.668 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 15.7 mm-40 -85.57 -23.98 27.41 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.865 0.866 . . . . 0.0 111.502 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -87.16 142.45 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 123.586 0.754 . . . . 0.0 111.051 -172.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.0 t -150.15 177.94 9.44 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.522 1.129 . . . . 0.0 109.195 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.7 mtt-85 -69.86 -24.7 63.47 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.87 0.468 . . . . 0.0 110.599 172.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -65.8 -32.39 73.9 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.102 0.876 . . . . 0.0 110.814 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.8 m -60.34 106.64 0.55 Allowed 'General case' 0 C--N 1.357 0.917 0 O-C-N 124.337 1.023 . . . . 0.0 110.551 -177.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.4 mtt-85 -81.4 155.48 25.88 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 169.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.8 mmt -69.68 90.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.789 0.68 . . . . 0.0 109.823 -176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -103.11 -18.09 15.1 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.276 1.03 . . . . 0.0 110.404 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -155.35 -47.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.949 1.3 . . . . 0.0 107.703 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.522 ' H ' HD12 ' A' ' 55' ' ' LEU . 1.6 mp -59.23 122.68 14.45 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.588 172.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.648 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . 53.75 21.88 2.9 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.098 0.959 . . . . 0.0 113.557 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -115.78 19.49 15.16 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 121.774 0.797 . . . . 0.0 111.41 -172.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 61' ' ' VAL . 24.3 t70 -147.79 149.12 31.76 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 172.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.3 p -50.0 -42.65 49.53 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.972 1.309 . . . . 0.0 113.147 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.3 -38.19 74.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 110.87 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.45 HG12 ' H ' ' A' ' 56' ' ' ALA . 25.2 t -76.15 -28.49 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.424 0.69 . . . . 0.0 111.304 -176.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.525 HG13 ' HB2' ' A' ' 82' ' ' LEU . 60.1 t -73.07 -43.26 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 124.096 0.959 . . . . 0.0 109.456 175.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.4 t -60.96 -43.06 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.838 0.711 . . . . 0.0 110.053 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 9.9 tp10 -65.65 -38.32 89.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.377 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.648 HD22 ' HB2' ' A' ' 56' ' ' ALA . 45.2 tp -64.23 -45.51 87.89 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 124.143 0.902 . . . . 0.0 110.521 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.6 t -65.44 -44.53 86.98 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.627 0.771 . . . . 0.0 111.292 -177.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.6 mt -67.53 -30.89 70.66 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.795 0.838 . . . . 0.0 111.219 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 34' ' ' VAL . 5.5 tppt? -72.84 -46.24 54.02 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 123.79 0.681 . . . . 0.0 109.409 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 98.9 mt -62.73 -32.17 73.23 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.637 174.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -67.28 -30.16 69.95 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.627 1.171 . . . . 0.0 111.803 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -93.4 -48.95 6.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.833 0.453 . . . . 0.0 110.658 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -65.05 -53.86 39.23 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.992 0.807 . . . . 0.0 111.334 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -110.37 -23.5 11.15 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.421 0.688 . . . . 0.0 112.088 -172.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.34 13.91 64.91 Favored Glycine 0 N--CA 1.478 1.477 0 CA-C-N 117.739 0.245 . . . . 0.0 112.837 -172.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.591 HG21 HG13 ' A' ' 95' ' ' VAL . 96.4 t -91.6 115.88 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.41 0.684 . . . . 0.0 110.224 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 15.2 t -149.27 169.68 20.21 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 124.247 1.019 . . . . 0.0 109.598 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.48 -2.79 87.63 Favored Glycine 0 C--N 1.345 1.057 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.564 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.425 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 27.8 m -98.36 17.75 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.699 1.2 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.58 -53.56 29.53 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.296 1.438 . . . . 0.0 112.172 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.15 -39.68 87.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.03 -23.05 61.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.992 0.917 . . . . 0.0 111.233 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HB2' HG13 ' A' ' 62' ' ' VAL . 81.7 mt -71.59 -33.48 69.09 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.404 0.682 . . . . 0.0 110.351 173.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -62.27 -40.23 95.53 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.602 0.564 . . . . 0.0 110.795 170.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.85 -24.07 63.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.322 0.649 . . . . 0.0 111.754 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.6 124.82 24.65 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 174.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -117.88 6.21 12.23 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.343 0.657 . . . . 0.0 109.324 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.7 p -145.38 143.44 30.11 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.893 0.877 . . . . 0.0 110.836 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.61 -32.09 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.646 172.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.72 -42.66 97.89 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.186 0.595 . . . . 0.0 111.633 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -27.79 63.63 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.502 0.321 . . . . 0.0 111.193 174.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -63.42 -38.65 91.96 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.346 0.258 . . . . 0.0 110.809 170.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -56.87 -58.44 8.14 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.399 0.679 . . . . 0.0 111.064 176.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -64.52 -29.7 70.73 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.826 0.704 . . . . 0.0 111.489 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.9 -56.71 10.39 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.517 0.511 . . . . 0.0 110.999 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.591 HG13 HG21 ' A' ' 75' ' ' VAL . 96.9 t -59.77 -48.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 O-C-N 123.73 0.644 . . . . 0.0 110.728 -177.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -65.22 -46.15 81.84 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.575 0.75 . . . . 0.0 112.869 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -65.06 -47.47 77.19 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.813 0.339 . . . . 0.0 110.41 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -74.48 -17.56 60.75 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.126 0.97 . . . . 0.0 111.968 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.555 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -80.79 -46.31 15.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.064 0.545 . . . . 0.0 109.91 176.494 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.1 -32.38 66.94 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.281 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.915 0 C-N-CA 124.765 1.226 . . . . 0.0 108.746 177.02 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.5 ptt? . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.537 -0.745 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -47.02 -63.2 1.1 Allowed 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -168.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.4 -26.22 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.302 0.641 . . . . 0.0 111.159 -178.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 m170 -75.52 -35.81 60.67 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.08 0.952 . . . . 0.0 111.018 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -77.73 -34.31 52.62 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.37 -31.43 71.66 Favored 'General case' 0 CA--C 1.559 1.323 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.138 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 m -67.53 -41.81 83.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.645 0.778 . . . . 0.0 110.717 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.66 -43.75 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.496 0.719 . . . . 0.0 110.788 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.16 -33.53 76.22 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.495 0.718 . . . . 0.0 111.199 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.2 t -64.38 -36.98 85.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.353 0.661 . . . . 0.0 111.22 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.41 -48.73 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.827 176.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.6 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -67.12 -29.34 69.04 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.161 0.985 . . . . 0.0 112.398 -171.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.407 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 84.5 p -91.15 -52.61 4.74 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.123 0.569 . . . . 0.0 109.518 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.29 -10.44 28.78 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.761 -175.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.403 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -80.61 156.91 72.85 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.212 0.605 . . . . 0.0 110.071 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.46 155.9 59.7 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.281 1.987 . . . . 0.0 112.546 172.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -60.27 -23.31 64.03 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.286 1.034 . . . . 0.0 112.077 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -63.53 -38.07 89.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.209 1.003 . . . . 0.0 111.713 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -87.1 -0.9 57.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.451 0.7 . . . . 0.0 112.347 -174.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.56 HG23 HD13 ' A' ' 55' ' ' LEU . 44.1 mt -98.36 137.86 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.166 0.586 . . . . 0.0 109.937 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 t -144.38 151.8 39.79 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.302 0.641 . . . . 0.0 109.367 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.434 ' NH1' ' HB2' ' A' ' 49' ' ' ASP . 5.0 ppt_? -62.78 -30.99 71.88 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 123.765 0.666 . . . . 0.0 109.667 167.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.434 ' HB2' ' NH1' ' A' ' 48' ' ' ARG . 34.5 t70 -83.42 80.22 9.16 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 123.55 0.74 . . . . 0.0 109.148 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.4 t -165.27 147.5 7.81 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.698 -177.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -85.82 27.27 0.88 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.292 0.637 . . . . 0.0 110.462 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 15.6 mmt 68.11 36.22 3.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.63 1.172 . . . . 0.0 110.023 -165.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -59.26 88.2 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.39 1.076 . . . . 0.0 111.726 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 64.91 11.33 6.91 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.164 1.385 . . . . 0.0 112.024 -178.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.56 HD13 HG23 ' A' ' 46' ' ' ILE . 83.9 mt -97.02 -40.96 8.6 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.553 0.741 . . . . 0.0 110.925 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.681 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -158.51 -167.15 2.08 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.839 0.856 . . . . 0.0 109.984 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.4 t80 81.84 -27.51 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 125.829 1.652 . . . . 0.0 112.098 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.7 136.49 56.87 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.584 0.754 . . . . 0.0 109.947 167.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.0 m -52.61 -44.0 65.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 112.967 -173.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.2 tp -69.73 -38.43 76.87 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.88 0.472 . . . . 0.0 110.818 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.6 HG13 ' HB1' ' A' ' 38' ' ' ALA . 49.1 t -66.86 -37.5 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.711 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.6 t -67.88 -34.38 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 123.343 0.657 . . . . 0.0 110.463 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.1 m -61.85 -49.43 76.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.198 0.599 . . . . 0.0 110.264 175.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -66.91 -37.71 84.86 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.107 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 55.3 tp -68.04 -43.64 78.23 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.774 0.829 . . . . 0.0 110.398 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.2 t -65.48 -43.01 91.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.42 0.688 . . . . 0.0 110.839 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.64 -36.58 84.29 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.124 0.89 . . . . 0.0 110.55 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -70.54 -50.93 32.42 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.334 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 95.7 mt -60.25 -38.38 83.3 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.613 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -59.0 -53.96 52.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.156 0.982 . . . . 0.0 112.17 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -84.91 -62.94 1.42 Allowed 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.818 0.342 . . . . 0.0 110.888 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -65.69 -47.76 74.36 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.008 0.923 . . . . 0.0 112.218 -166.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -91.2 -20.77 21.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.137 0.575 . . . . 0.0 111.813 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.55 0.57 89.38 Favored Glycine 0 C--N 1.352 1.429 0 N-CA-C 113.87 0.308 . . . . 0.0 113.87 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.88 108.82 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 124.286 1.034 . . . . 0.0 109.941 -177.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -133.27 166.47 22.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.155 0.582 . . . . 0.0 110.584 -176.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.29 18.02 79.76 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-N 116.334 -0.394 . . . . 0.0 112.475 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.9 m -110.42 15.79 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.484 1.114 . . . . 0.0 110.614 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.22 -45.24 88.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.709 1.204 . . . . 0.0 111.939 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.402 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 24.7 m-20 -68.35 -36.47 79.28 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.694 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.95 -27.96 64.12 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.188 0.595 . . . . 0.0 111.199 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 99.3 mt -74.32 -26.88 60.43 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.51 0.724 . . . . 0.0 110.853 175.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.11 -37.31 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.184 171.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 80' ' ' ASP . 86.9 mt -84.86 16.35 3.4 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.096 0.958 . . . . 0.0 112.636 -176.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.23 127.32 32.66 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.013 0.435 . . . . 0.0 111.231 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -93.07 -58.65 2.25 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.344 176.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.0 p -119.65 169.34 10.18 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.503 HG22 ' SD ' ' A' ' 52' ' ' MET . 47.6 t -70.07 -33.38 54.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.685 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.64 -40.01 90.38 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.031 0.933 . . . . 0.0 110.611 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -58.78 -43.13 90.33 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.357 1.063 . . . . 0.0 110.54 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 44.0 tp -61.37 -46.09 91.65 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.485 0.714 . . . . 0.0 111.945 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -58.73 -42.96 89.94 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 123.377 0.423 . . . . 0.0 111.081 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.28 -37.53 83.56 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.823 0.449 . . . . 0.0 111.481 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.51 -57.75 10.05 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.374 0.67 . . . . 0.0 110.903 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.15 -35.37 71.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.448 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.98 -45.04 90.82 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.206 1.002 . . . . 0.0 111.473 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -65.57 -41.3 93.09 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.807 -178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -79.97 -17.53 52.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.337 0.655 . . . . 0.0 111.975 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -72.22 -44.88 62.26 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.743 0.817 . . . . 0.0 109.453 174.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.29 -66.26 0.87 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.062 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.492 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.283 176.136 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.7 tmm? . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -65.61 -62.97 1.21 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.391 0.677 . . . . 0.0 112.395 -166.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.85 -34.81 73.61 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.652 0.781 . . . . 0.0 110.85 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -68.58 -35.55 77.53 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.466 0.706 . . . . 0.0 111.636 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.502 HD21 ' HG ' ' A' ' 91' ' ' LEU . 59.2 tp -71.7 -36.6 70.6 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 tp -61.76 -36.93 82.46 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.918 0.887 . . . . 0.0 110.623 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 m -70.43 -40.0 74.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.837 0.855 . . . . 0.0 110.405 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.6 t -60.56 -38.79 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.902 0.881 . . . . 0.0 110.538 176.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 91' ' ' LEU . 95.9 mt -72.62 -33.95 67.01 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.753 0.821 . . . . 0.0 111.287 177.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.1 t -60.85 -38.09 84.34 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.468 0.48 . . . . 0.0 110.694 176.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.3 t -79.61 -37.14 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.686 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.56 71.52 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 0.0 111.979 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m -88.7 -40.33 13.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.595 0.758 . . . . 0.0 110.471 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.36 -32.02 7.36 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.0 -175.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.5 m -73.84 143.63 81.6 Favored Pre-proline 0 CA--C 1.556 1.189 0 C-N-CA 123.583 0.753 . . . . 0.0 110.233 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.93 168.9 8.12 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.849 2.366 . . . . 0.0 113.532 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -63.39 -25.71 68.41 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.984 0.913 . . . . 0.0 112.149 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -69.07 -27.91 66.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.384 1.074 . . . . 0.0 110.854 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -76.83 -23.09 52.77 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.823 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.578 HG23 HD13 ' A' ' 55' ' ' LEU . 21.2 mt -109.0 144.24 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.749 0.819 . . . . 0.0 110.222 -173.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.7 t -156.07 170.8 21.35 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.012 1.325 . . . . 0.0 108.135 174.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -62.27 -32.66 73.4 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.97 0.508 . . . . 0.0 110.417 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -95.04 -1.65 51.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.421 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.3 m -71.74 -6.15 39.2 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.028 0.531 . . . . 0.0 112.339 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 72.4 mtp85 68.47 170.45 0.28 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.872 1.269 . . . . 0.0 112.638 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.781 ' HG3' ' HB2' ' A' ' 57' ' ' PHE . 44.7 tpp -112.63 90.88 3.46 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.181 -172.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 57' ' ' PHE . 10.3 tp10 -109.84 -68.73 0.9 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.139 0.976 . . . . 0.0 109.921 176.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -116.18 -18.47 10.57 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.95 0.9 . . . . 0.0 110.824 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.578 HD13 HG23 ' A' ' 46' ' ' ILE . 84.3 mt -60.95 -32.75 72.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.268 1.027 . . . . 0.0 112.842 -171.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.504 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.37 13.96 0.06 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.393 0.677 . . . . 0.0 112.072 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.781 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 81.6 t80 -100.17 -32.22 11.01 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.538 0.335 . . . . 0.0 110.936 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -55.6 133.43 50.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.901 -0.571 . . . . 0.0 109.568 176.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.8 t -52.95 -37.86 61.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.371 1.069 . . . . 0.0 113.022 -170.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 53.1 tp -68.46 -43.98 75.83 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 123.48 0.488 . . . . 0.0 110.492 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.69 -28.53 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.4 t -67.34 -49.14 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.258 0.623 . . . . 0.0 110.241 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.9 m -63.59 -40.14 96.18 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 124.022 0.826 . . . . 0.0 110.718 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -67.14 -41.09 86.66 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.112 0.965 . . . . 0.0 111.051 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.5 HD22 ' HB1' ' A' ' 56' ' ' ALA . 35.0 tp -67.66 -48.87 65.44 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 123.453 0.47 . . . . 0.0 110.209 -175.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.0 t -64.22 -32.71 74.4 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.796 0.438 . . . . 0.0 110.742 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 9.9 tt -63.5 -52.36 61.58 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.243 1.017 . . . . 0.0 109.955 176.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.442 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.1 OUTLIER -74.09 -42.67 59.77 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.572 -173.312 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.505 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 60.8 mt -61.43 -28.99 69.66 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.101 176.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 45.9 ttp180 -57.16 -32.09 66.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.232 1.013 . . . . 0.0 111.681 177.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -97.14 -50.83 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.773 0.829 . . . . 0.0 111.046 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 25.4 mm-40 -62.28 -53.02 61.1 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.379 1.072 . . . . 0.0 112.226 -171.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -120.53 -4.36 9.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.219 0.607 . . . . 0.0 111.822 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.64 20.06 79.77 Favored Glycine 0 C--N 1.351 1.392 0 C-N-CA 123.364 0.507 . . . . 0.0 114.146 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.507 HG21 HG13 ' A' ' 95' ' ' VAL . 51.0 t -90.93 117.41 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.704 0.802 . . . . 0.0 109.532 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.8 m -145.41 150.25 36.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.008 0.923 . . . . 0.0 110.672 -171.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.41 15.8 78.96 Favored Glycine 0 C--N 1.359 1.825 0 O-C-N 123.555 0.534 . . . . 0.0 112.861 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.22 8.19 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.328 1.051 . . . . 0.0 111.055 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 3.1 m-20 -54.0 -43.04 69.72 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 125.206 1.403 . . . . 0.0 112.29 -173.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.3 -43.77 96.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 113.765 -1.561 . . . . 0.0 110.051 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 30.5 tt0 -73.43 -28.89 62.22 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.721 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.432 HD23 HD13 ' A' ' 94' ' ' LEU . 93.0 mt -62.8 -37.97 88.82 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.077 0.951 . . . . 0.0 110.265 176.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.29 -39.03 75.1 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.036 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.78 -14.21 62.88 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 94' ' ' LEU . 57.7 mt -70.82 123.2 21.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.887 0.475 . . . . 0.0 110.451 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' HG3' HG23 ' A' ' 87' ' ' THR . 10.7 pt-20 -93.12 -22.78 18.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.583 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.501 HG23 ' HG3' ' A' ' 86' ' ' GLU . 67.5 p -133.81 159.14 41.53 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.571 0.748 . . . . 0.0 111.122 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 t -69.22 -26.89 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.116 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 93' ' ' GLN . 33.0 t70 -61.11 -43.91 98.16 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.191 0.596 . . . . 0.0 110.408 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HB3' HD22 ' A' ' 85' ' ' LEU . 74.0 mm-40 -60.62 -32.38 71.52 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 123.882 0.739 . . . . 0.0 111.545 172.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 35' ' ' LEU . 34.0 tp -67.83 -41.41 83.07 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 175.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -60.8 -40.37 92.42 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.956 0.408 . . . . 0.0 109.927 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 89' ' ' ASP . 76.7 mt-30 -64.1 -40.41 96.17 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.117 174.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 85' ' ' LEU . 6.1 tt -59.64 -49.94 75.8 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.264 1.026 . . . . 0.0 110.907 -176.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.507 HG13 HG21 ' A' ' 75' ' ' VAL . 63.3 t -62.87 -50.81 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -65.11 -24.26 67.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 123.816 0.698 . . . . 0.0 112.435 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -67.33 -51.59 50.57 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.24 1.016 . . . . 0.0 109.854 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -82.49 -16.56 48.32 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.402 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -41.4 28.25 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.22 1.008 . . . . 0.0 109.33 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.35 -51.78 9.59 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.47 0.708 . . . . 0.0 110.677 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 176.596 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HA ' ' HE1' ' A' ' 92' ' ' PHE . 51.3 mt-10 -59.93 -53.03 62.69 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 123.347 0.659 . . . . 0.0 110.492 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.83 -34.79 78.97 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.241 -179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -64.11 -38.26 90.43 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.409 0.683 . . . . 0.0 111.867 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 58.3 mt -69.16 -38.55 78.79 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.175 0.512 . . . . 0.0 111.016 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tp -67.86 -37.39 81.77 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.952 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.6 m -76.13 -37.51 57.93 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.653 1.181 . . . . 0.0 110.936 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 31' ' ' LEU . 11.7 p -68.96 -35.4 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 117.78 0.264 . . . . 0.0 110.614 -176.141 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.406 HD22 ' HB2' ' A' ' 56' ' ' ALA . 91.0 mt -67.64 -39.74 84.6 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.543 173.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.1 t -59.65 -51.73 68.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.678 0.791 . . . . 0.0 111.733 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.4 t -71.04 -45.8 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 123.958 0.903 . . . . 0.0 111.335 -174.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.32 80.48 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.045 0.538 . . . . 0.0 111.627 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.6 m -85.93 -15.89 40.21 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.933 0.493 . . . . 0.0 111.666 178.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.02 6.73 89.02 Favored Glycine 0 C--N 1.352 1.468 0 C-N-CA 122.739 0.209 . . . . 0.0 113.495 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.752 HG21 HD23 ' A' ' 55' ' ' LEU . 27.1 m -88.44 161.52 42.37 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 124.923 1.289 . . . . 0.0 111.003 -178.096 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.23 149.03 92.11 Favored 'Trans proline' 0 C--N 1.367 1.529 0 C-N-CA 122.416 2.077 . . . . 0.0 111.36 162.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -70.04 -19.26 63.31 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.239 0.616 . . . . 0.0 110.53 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.37 -27.46 64.25 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.132 0.973 . . . . 0.0 112.65 172.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.83 -16.85 61.6 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.89 0.876 . . . . 0.0 111.454 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.13 125.19 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.666 0.786 . . . . 0.0 111.081 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.3 t -125.8 177.11 6.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.438 1.095 . . . . 0.0 108.066 168.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -68.52 -39.08 81.34 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 122.559 0.344 . . . . 0.0 110.982 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.36 -3.68 58.44 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.8 0.84 . . . . 0.0 112.025 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -72.36 164.69 25.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.229 0.612 . . . . 0.0 111.986 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 0.0 OUTLIER -110.38 132.39 54.22 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.377 0.608 . . . . 0.0 110.361 173.355 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 24.9 ptp -80.68 67.71 6.65 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 122.339 1.066 . . . . 0.0 109.104 171.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -86.14 -70.77 0.58 Allowed 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.54 -30.99 67.88 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 172.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.752 HD23 HG21 ' A' ' 41' ' ' VAL . 2.7 mp -91.07 140.52 29.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.592 1.157 . . . . 0.0 108.965 -173.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.462 ' HB3' ' HB2' ' A' ' 52' ' ' MET . . . 74.61 -37.32 0.35 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 170.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -63.53 -29.35 70.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.673 1.189 . . . . 0.0 113.726 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.11 135.88 48.75 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.491 0.717 . . . . 0.0 110.7 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 m -60.84 -33.08 72.5 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -171.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.17 -37.83 75.28 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.193 0.597 . . . . 0.0 109.964 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -72.57 -38.03 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.839 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.5 t -65.19 -34.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 C-N-CA 123.807 0.843 . . . . 0.0 110.328 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.4 t -62.68 -49.13 76.31 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.288 0.635 . . . . 0.0 109.82 178.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 9.1 tp10 -67.33 -41.88 84.53 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.172 0.589 . . . . 0.0 110.513 178.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.56 -44.46 96.99 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.678 1.191 . . . . 0.0 111.147 -177.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.6 p -65.79 -36.17 82.76 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.667 0.787 . . . . 0.0 110.991 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 96.9 mt -63.92 -40.6 96.85 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.913 0.758 . . . . 0.0 111.097 173.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 75.1 mmtt -67.58 -44.04 79.11 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.002 0.521 . . . . 0.0 111.076 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.5 mt -67.32 -35.68 79.91 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.582 0.353 . . . . 0.0 110.172 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -60.69 -39.37 88.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.958 1.303 . . . . 0.0 111.419 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' LEU . 74.2 mmtt -91.64 -68.06 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.926 0.49 . . . . 0.0 110.773 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -63.0 -42.66 99.91 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.249 1.02 . . . . 0.0 112.472 -169.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -98.08 -20.98 17.03 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.147 0.579 . . . . 0.0 111.041 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.89 -7.92 68.42 Favored Glycine 0 C--N 1.353 1.515 0 CA-C-O 119.893 -0.393 . . . . 0.0 113.16 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.449 HG21 HG13 ' A' ' 95' ' ' VAL . 68.9 t -75.75 98.4 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 124.534 1.133 . . . . 0.0 110.021 -175.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.7 m -109.17 154.86 21.76 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.485 1.114 . . . . 0.0 110.271 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.37 20.32 72.32 Favored Glycine 0 C--N 1.351 1.409 0 C-N-CA 123.251 0.453 . . . . 0.0 113.392 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.437 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 m -108.96 16.08 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.639 0.776 . . . . 0.0 110.982 -177.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.48 -56.89 14.96 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.099 1.359 . . . . 0.0 111.292 -175.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.33 -34.97 79.38 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.679 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -68.09 -30.69 69.92 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.636 0.775 . . . . 0.0 110.528 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 96.6 mt -70.4 -39.69 74.34 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.081 0.952 . . . . 0.0 110.96 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.62 -35.41 76.1 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.852 173.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.92 -19.99 53.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.5 0.72 . . . . 0.0 112.19 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.541 HD11 HD13 ' A' ' 94' ' ' LEU . 69.8 mt -67.88 138.65 56.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 117.95 0.341 . . . . 0.0 111.398 176.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -119.54 -38.07 3.05 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 123.364 0.665 . . . . 0.0 109.601 177.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 50.8 p -108.19 148.06 30.46 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 122.119 0.961 . . . . 0.0 112.164 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.452 HG12 ' CE2' ' A' ' 92' ' ' PHE . 34.0 t -65.71 -30.11 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 113.987 -1.46 . . . . 0.0 109.834 176.003 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.4 -46.49 80.15 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.067 0.947 . . . . 0.0 111.169 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.02 -32.99 74.73 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.264 176.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.98 -48.64 79.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 123.639 0.587 . . . . 0.0 111.902 174.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.452 ' CE2' HG12 ' A' ' 88' ' ' VAL . 64.3 m-85 -56.29 -45.09 80.33 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.235 0.614 . . . . 0.0 110.902 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 48.6 mt-30 -64.52 -49.24 72.07 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.944 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.541 HD13 HD11 ' A' ' 85' ' ' LEU . 8.5 tt -51.72 -57.85 8.08 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.053 1.341 . . . . 0.0 110.378 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.495 HG21 HD21 ' A' ' 31' ' ' LEU . 70.8 t -58.84 -38.75 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.657 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.5 -36.25 78.64 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.17 0.588 . . . . 0.0 111.906 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 34.3 mmtp -66.49 -39.26 88.64 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.214 0.606 . . . . 0.0 110.127 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -78.62 -24.69 45.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.134 0.574 . . . . 0.0 111.208 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -77.62 -32.31 53.37 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.362 0.665 . . . . 0.0 110.64 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.56 -62.12 1.32 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.674 0.79 . . . . 0.0 111.105 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.638 -171.829 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.47 ' O ' HD22 ' A' ' 32' ' ' LEU . 35.5 mt-10 -53.82 -48.63 69.72 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 123.941 0.896 . . . . 0.0 111.122 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.06 -47.05 78.67 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.159 0.912 . . . . 0.0 111.28 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.445 ' O ' HG23 ' A' ' 34' ' ' VAL . 55.4 t60 -73.19 -25.95 60.98 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.619 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.46 -40.02 85.33 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 0.9 OUTLIER -60.89 -40.48 93.22 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.513 0.325 . . . . 0.0 110.202 171.435 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -63.59 -37.99 89.41 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.556 0.742 . . . . 0.0 110.978 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 30' ' ' HIS . 61.1 t -62.61 -50.75 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 122.801 0.441 . . . . 0.0 109.852 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.74 -42.33 95.27 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 122.697 0.399 . . . . 0.0 111.593 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.2 p -64.69 -39.6 93.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.563 0.745 . . . . 0.0 111.96 -174.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.56 -31.33 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.293 175.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.97 -7.71 59.04 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 0.0 112.509 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -112.31 -61.54 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.426 0.69 . . . . 0.0 109.987 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.12 -34.42 2.26 Favored Glycine 0 C--N 1.341 0.84 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.292 -173.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.19 154.87 92.08 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 123.19 0.596 . . . . 0.0 111.1 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -55.23 152.57 30.75 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 123.008 2.472 . . . . 0.0 113.27 168.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.594 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 21.4 ptmt -69.71 -22.81 63.37 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.599 0.76 . . . . 0.0 111.817 -179.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -73.21 -25.4 60.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.336 0.654 . . . . 0.0 110.505 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -72.95 -18.58 61.37 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.446 0.698 . . . . 0.0 111.593 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.0 mt -102.19 124.23 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.312 0.645 . . . . 0.0 109.704 -177.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -133.42 -179.88 5.79 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.297 1.039 . . . . 0.0 108.723 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.497 ' HB3' ' HB2' ' A' ' 89' ' ' ASP . 5.5 mpt_? -58.85 -55.12 39.2 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.004 0.922 . . . . 0.0 111.585 -172.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -90.47 3.92 52.53 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 0.0 112.343 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.5 m -74.48 -0.76 18.55 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 49.7 mtt180 66.81 170.74 0.25 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 112.259 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.75 ' SD ' HD22 ' A' ' 91' ' ' LEU . 72.5 mtm -116.45 29.54 7.89 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.231 1.013 . . . . 0.0 108.973 168.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.98 -55.83 30.11 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.207 0.942 . . . . 0.0 110.795 -172.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -101.72 16.21 26.53 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.972 0.909 . . . . 0.0 110.568 177.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 74.4 mt -114.34 -68.14 0.95 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.842 0.457 . . . . 0.0 111.615 -171.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -112.24 -21.4 11.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -173.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -70.6 89.65 0.73 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.162 0.585 . . . . 0.0 110.32 -176.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -177.62 146.97 0.48 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.616 1.566 . . . . 0.0 108.213 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -56.49 -46.6 80.41 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.386 0.674 . . . . 0.0 112.049 -177.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.41 -37.84 63.24 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.022 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.19 -32.8 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.218 0.324 . . . . 0.0 111.736 -175.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.5 -37.42 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 171.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 70.7 m -67.25 -37.28 83.24 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.013 0.525 . . . . 0.0 111.272 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.43 -37.2 65.94 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.7 tp -66.68 -48.11 70.34 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.494 ' HB3' HD12 ' A' ' 82' ' ' LEU . 40.8 p -66.62 -33.23 75.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.216 0.607 . . . . 0.0 111.665 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 56.2 tp -69.31 -40.4 77.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.348 0.659 . . . . 0.0 110.516 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -71.99 -42.09 66.87 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.392 0.677 . . . . 0.0 110.39 -177.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 93.3 mt -66.57 -38.55 87.31 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.052 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -55.27 -45.08 76.16 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.582 1.153 . . . . 0.0 111.516 177.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.7 -66.51 0.69 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.762 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.94 -54.49 6.5 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.043 -165.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -89.5 -11.68 42.23 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.454 -174.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.57 -7.6 53.03 Favored Glycine 0 C--N 1.355 1.612 0 C-N-CA 123.836 0.731 . . . . 0.0 114.393 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.455 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 48.5 t -77.56 102.79 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.84 0.856 . . . . 0.0 110.777 -171.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 t -137.32 169.36 17.92 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.695 0.798 . . . . 0.0 110.313 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.01 14.62 78.7 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.538 -176.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 35.7 m -119.91 16.17 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.429 1.092 . . . . 0.0 111.274 -173.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -54.94 -44.76 74.58 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.04 0.936 . . . . 0.0 112.216 -173.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -67.07 -34.09 76.92 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.458 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.3 mp0 -67.43 -38.5 84.66 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.668 0.605 . . . . 0.0 110.381 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 66' ' ' SER . 97.7 mt -63.91 -31.47 72.66 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.333 0.653 . . . . 0.0 111.197 178.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -75.1 -35.02 61.8 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.512 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -69.84 -23.46 63.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.631 0.772 . . . . 0.0 111.384 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.602 HD11 HD13 ' A' ' 94' ' ' LEU . 95.1 mt -76.31 118.11 18.68 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 122.938 0.495 . . . . 0.0 110.475 178.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.87 -13.76 19.92 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.682 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -137.55 144.09 41.91 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 124.086 0.954 . . . . 0.0 111.477 -168.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.7 t -75.23 -23.66 17.2 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.06 -171.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.497 ' HB2' ' HB3' ' A' ' 48' ' ' ARG . 31.7 t70 -59.62 -50.06 75.36 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.452 0.644 . . . . 0.0 110.239 178.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -68.02 -31.56 71.32 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.319 -1.31 . . . . 0.0 110.556 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.75 HD22 ' SD ' ' A' ' 52' ' ' MET . 52.5 tp -64.33 -47.29 79.92 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 123.406 0.441 . . . . 0.0 111.586 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -56.73 -45.96 81.64 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.599 0.76 . . . . 0.0 109.881 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.78 -34.06 74.92 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.863 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.602 HD13 HD11 ' A' ' 85' ' ' LEU . 9.4 tt -70.32 -47.03 62.96 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.62 -48.69 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 123.42 0.688 . . . . 0.0 110.057 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.71 -36.34 80.45 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.602 0.761 . . . . 0.0 111.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -64.43 -48.65 74.54 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.306 0.642 . . . . 0.0 110.5 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -77.37 -18.45 57.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.695 0.798 . . . . 0.0 111.499 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -78.44 -46.46 19.73 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.482 0.713 . . . . 0.0 110.282 176.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.51 -62.27 1.58 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.36 0.664 . . . . 0.0 109.901 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.907 179.103 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.45 ' SD ' ' NH1' ' A' ' 99' ' ' ARG . 20.1 ttt . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.87 -58.73 6.39 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.121 0.568 . . . . 0.0 110.555 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -62.09 -31.55 72.01 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.17 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.425 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.1 t60 -71.91 -31.68 66.63 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.63 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.3 -37.56 85.69 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.896 0.478 . . . . 0.0 109.713 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -65.09 -35.9 82.61 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.751 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.5 m -66.53 -41.66 88.44 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.238 0.615 . . . . 0.0 110.069 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 30' ' ' HIS . 43.9 t -58.76 -47.04 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.069 0.948 . . . . 0.0 110.294 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' HD23 ' A' ' 55' ' ' LEU . 98.2 mt -68.35 -37.69 80.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.342 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.7 t -64.6 -39.52 93.87 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.085 0.954 . . . . 0.0 111.253 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 65.7 t -78.7 -30.54 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.379 0.672 . . . . 0.0 110.201 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.93 -25.95 53.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.316 0.646 . . . . 0.0 112.156 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.5 p -108.26 -66.11 1.07 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.002 0.521 . . . . 0.0 110.151 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.06 -27.04 2.81 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-O 119.847 -0.418 . . . . 0.0 112.163 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.05 131.66 88.85 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.967 0.507 . . . . 0.0 110.813 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.66 158.82 26.53 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 123.304 2.669 . . . . 0.0 112.478 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -63.12 -21.1 65.96 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.719 0.808 . . . . 0.0 112.51 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -65.83 -26.16 67.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.765 0.826 . . . . 0.0 111.335 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -100.29 8.27 43.84 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.885 0.874 . . . . 0.0 111.914 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 HD21 ' A' ' 55' ' ' LEU . 38.4 mt -113.14 140.08 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.188 0.595 . . . . 0.0 109.876 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -151.55 173.33 14.75 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.517 1.127 . . . . 0.0 109.366 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -30.25 69.92 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.463 0.649 . . . . 0.0 110.0 169.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.39 15.58 10.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.526 1.13 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.486 ' HB3' HG21 ' A' ' 88' ' ' VAL . 47.9 t -70.22 -21.38 63.02 Favored 'General case' 0 C--N 1.358 0.976 0 O-C-N 122.052 -0.405 . . . . 0.0 110.452 171.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 56.45 23.18 7.19 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.834 1.253 . . . . 0.0 113.404 169.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.638 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 14.3 mmt 60.4 54.58 3.82 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.195 0.998 . . . . 0.0 111.928 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 50' ' ' SER . 20.0 mm-40 -68.8 -71.31 0.22 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.179 0.514 . . . . 0.0 110.208 177.315 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.03 -19.99 14.01 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.915 1.286 . . . . 0.0 109.837 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 35' ' ' LEU . 4.4 mp -93.15 133.12 36.65 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.21 1.004 . . . . 0.0 110.357 -168.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.638 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 68.38 -69.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.861 1.664 . . . . 0.0 112.051 176.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.578 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 43.9 t80 -56.79 90.84 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.342 1.457 . . . . 0.0 111.776 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.1 t70 176.14 146.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 106.513 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 56.2 p -56.84 -45.48 82.34 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.054 0.542 . . . . 0.0 112.271 -175.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.6 tp -70.37 -49.08 52.92 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.279 0.632 . . . . 0.0 110.867 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 18.5 t -71.53 -26.45 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 123.43 0.457 . . . . 0.0 111.322 -172.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.91 -43.96 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.506 0.722 . . . . 0.0 109.646 172.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.1 m -62.27 -36.5 82.25 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.468 0.651 . . . . 0.0 111.122 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 25.6 tt0 -75.22 -37.84 60.93 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.306 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 35.1 tp -65.47 -28.45 69.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.319 0.648 . . . . 0.0 110.673 176.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 58.2 m -63.07 -49.48 74.36 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.097 0.959 . . . . 0.0 110.553 175.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -75.19 -19.94 59.56 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 119.217 -0.421 . . . . 0.0 112.126 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.551 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 72.9 mmtt -64.43 -62.88 1.32 Allowed 'General case' 0 C--N 1.367 1.365 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.63 -30.46 69.88 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.524 1.129 . . . . 0.0 111.802 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -52.9 -49.24 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.913 1.285 . . . . 0.0 110.451 173.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -91.42 -24.5 19.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.52 0.728 . . . . 0.0 111.722 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -85.64 -52.98 5.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.821 0.848 . . . . 0.0 111.571 -166.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -117.58 -2.19 11.52 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.365 0.666 . . . . 0.0 110.848 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.5 -3.88 83.56 Favored Glycine 0 C--N 1.353 1.515 0 C-N-CA 122.992 0.329 . . . . 0.0 113.409 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.411 HG12 HG22 ' A' ' 78' ' ' VAL . 13.0 t -89.36 98.44 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.8 t -80.17 143.66 33.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.177 0.591 . . . . 0.0 112.336 -169.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.32 -87.22 0.5 Allowed Glycine 0 C--N 1.351 1.377 0 O-C-N 124.287 0.992 . . . . 0.0 112.872 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.584 HG12 ' HB3' ' A' ' 81' ' ' GLU . 3.5 t 62.3 21.93 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 C-N-CA 124.518 1.127 . . . . 0.0 110.032 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.07 -41.22 74.77 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.814 1.246 . . . . 0.0 112.663 -168.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -62.08 -44.87 95.73 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 123.875 0.734 . . . . 0.0 111.009 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.584 ' HB3' HG12 ' A' ' 78' ' ' VAL . 8.4 tp10 -72.61 -47.88 44.15 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.186 -175.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.87 -30.61 70.98 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.971 0.908 . . . . 0.0 111.475 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.76 -44.89 80.21 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.508 0.723 . . . . 0.0 110.476 171.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -71.57 -27.75 63.37 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.901 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 80.0 mt -66.67 111.98 3.95 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.384 0.611 . . . . 0.0 110.791 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -100.52 -22.07 15.12 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.285 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.96 149.22 50.43 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.377 0.671 . . . . 0.0 111.286 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.486 HG21 ' HB3' ' A' ' 50' ' ' SER . 45.0 t -66.0 -28.42 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.218 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 17.7 t70 -60.04 -41.46 92.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 122.761 0.424 . . . . 0.0 110.559 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.44 -29.9 69.49 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.23 0.612 . . . . 0.0 111.625 175.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 69.3 tp -64.74 -39.37 93.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.557 0.343 . . . . 0.0 110.623 171.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.72 -41.07 98.14 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.773 0.429 . . . . 0.0 110.522 174.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 73.6 mm-40 -62.45 -42.13 99.24 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.817 0.447 . . . . 0.0 110.509 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.582 HD13 ' HG2' ' A' ' 81' ' ' GLU . 42.3 tp -59.65 -61.01 2.94 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.057 0.943 . . . . 0.0 110.897 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 87.7 t -64.44 -40.75 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.151 0.581 . . . . 0.0 111.099 -172.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.02 -53.57 24.91 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.52 0.728 . . . . 0.0 110.246 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -66.51 -36.07 81.8 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.396 0.678 . . . . 0.0 111.707 -174.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 -84.7 -22.53 29.73 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.45 ' NH1' ' SD ' ' A' ' 27' ' ' MET . 46.5 ttt180 -74.62 -37.85 62.71 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.46 -51.88 52.1 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.791 0.837 . . . . 0.0 110.244 172.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 126.464 1.906 . . . . 0.0 112.118 -178.872 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.5 tmm? . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.19 -61.83 2.1 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 124.054 0.846 . . . . 0.0 111.721 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 30.5 t70 -69.85 -24.69 63.48 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.881 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -65.77 -33.45 75.9 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.429 0.692 . . . . 0.0 110.477 170.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 91' ' ' LEU . 10.4 tt -68.8 -37.05 78.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.071 0.548 . . . . 0.0 110.079 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.566 HD23 ' HA ' ' A' ' 29' ' ' ASP . 2.6 mm? -62.77 -34.98 78.38 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 123.03 0.206 . . . . 0.0 111.144 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 37' ' ' VAL . 11.9 m -63.22 -42.22 99.24 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.457 0.703 . . . . 0.0 110.609 176.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.526 HG13 ' HG2' ' A' ' 68' ' ' LYS . 41.4 t -63.82 -43.07 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.38 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.02 -39.44 93.4 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.049 0.54 . . . . 0.0 111.484 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.5 p -68.15 -31.56 71.22 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.484 0.49 . . . . 0.0 111.682 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 33' ' ' THR . 87.8 t -75.04 -39.87 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.058 0 C-N-CA 122.876 0.47 . . . . 0.0 110.155 174.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.58 -29.94 62.71 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.649 0.78 . . . . 0.0 112.244 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.6 p -94.42 -53.78 3.78 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.192 0.597 . . . . 0.0 110.147 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.55 -15.04 9.89 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.951 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.8 m -92.67 145.72 30.9 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.363 0.665 . . . . 0.0 110.523 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -51.25 158.16 3.83 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.836 3.024 . . . . 0.0 115.162 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -63.35 -22.83 67.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.473 1.109 . . . . 0.0 111.984 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.42 -29.21 68.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.785 0.434 . . . . 0.0 111.147 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.62 0.56 56.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.601 0.761 . . . . 0.0 111.0 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.469 HG22 HD12 ' A' ' 32' ' ' LEU . 34.9 mt -129.82 105.96 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 123.674 0.789 . . . . 0.0 110.751 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.8 t -110.72 -177.77 3.31 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.737 0.815 . . . . 0.0 109.172 170.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.9 ptp85 -67.11 -33.36 75.3 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 173.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -70.43 -19.48 62.98 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.235 1.014 . . . . 0.0 111.3 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 m -66.44 149.23 50.73 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.873 0.844 . . . . 0.0 111.499 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.569 ' HD3' HG22 ' A' ' 87' ' ' THR . 16.4 mmt180 -82.98 -161.45 0.49 Allowed 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.183 178.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 49.5 mtt -130.99 -2.61 4.04 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.94 -10.92 23.98 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 118.833 0.742 . . . . 0.0 112.698 -173.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -141.88 26.57 1.88 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.746 0.818 . . . . 0.0 109.675 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 72.5 mt -136.35 -32.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.701 0.8 . . . . 0.0 112.616 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.51 -41.32 0.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 122.797 0.439 . . . . 0.0 112.0 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -61.28 87.78 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.925 1.29 . . . . 0.0 111.242 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 175.38 133.12 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.238 1.815 . . . . 0.0 106.307 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.3 m -52.29 -38.22 57.75 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 119.026 0.83 . . . . 0.0 113.17 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.04 -41.23 62.12 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.472 0.709 . . . . 0.0 111.141 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.9 t -76.98 -24.84 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 122.317 0.247 . . . . 0.0 110.627 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.0 -39.95 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 171.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.2 t -62.92 -43.61 98.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.631 0.772 . . . . 0.0 111.009 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -72.53 -38.36 68.05 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.567 0.747 . . . . 0.0 111.376 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.14 -46.09 75.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.291 0.636 . . . . 0.0 109.795 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.7 t -63.37 -31.8 73.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.123 0.969 . . . . 0.0 111.258 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.66 -46.57 87.61 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.526 ' HG2' HG13 ' A' ' 34' ' ' VAL . 0.1 OUTLIER -71.67 -35.88 70.45 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.461 -177.257 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.53 -42.55 78.33 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.847 0.459 . . . . 0.0 110.011 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 76' ' ' THR . 2.0 tmt_? -64.56 -48.22 75.83 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.302 1.041 . . . . 0.0 110.221 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -82.31 -67.13 0.81 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.312 -175.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -77.77 -47.73 18.28 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.84 -164.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.464 ' CE1' HG21 ' A' ' 34' ' ' VAL . 80.2 m-85 -79.53 -24.43 42.2 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.047 0.539 . . . . 0.0 110.982 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.0 -5.22 83.64 Favored Glycine 0 C--N 1.349 1.287 0 O-C-N 123.279 0.362 . . . . 0.0 113.369 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 HG21 ' A' ' 78' ' ' VAL . 40.7 t -81.9 87.92 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.271 1.029 . . . . 0.0 108.681 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 45.8 p -71.16 134.63 47.1 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.963 -168.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.62 -110.24 3.02 Favored Glycine 0 C--N 1.348 1.227 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.291 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG11 HD21 ' A' ' 94' ' ' LEU . 10.2 t 69.46 8.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 125.571 1.549 . . . . 0.0 110.823 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -48.61 -41.78 32.01 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.387 1.475 . . . . 0.0 113.146 -168.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.52 -46.91 71.48 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.365 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -73.91 -25.0 59.77 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.69 0.396 . . . . 0.0 110.838 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.15 -32.62 70.67 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.978 0.911 . . . . 0.0 110.418 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -68.21 -36.29 79.32 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.072 171.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.91 -1.75 36.66 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.542 0.737 . . . . 0.0 112.589 177.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.495 HD11 HD13 ' A' ' 94' ' ' LEU . 65.7 mt -80.76 151.81 28.62 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.284 0.493 . . . . 0.0 111.599 176.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -132.45 -44.81 0.91 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 109.361 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.569 HG22 ' HD3' ' A' ' 51' ' ' ARG . 64.1 p -117.4 156.4 27.98 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.443 0.697 . . . . 0.0 110.852 -177.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 90.6 t -67.9 -33.16 59.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.15 174.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.22 -38.96 81.24 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.089 0.956 . . . . 0.0 110.589 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.07 -31.88 66.52 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.147 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 31' ' ' LEU . 44.1 tp -67.39 -33.9 76.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.124 0.57 . . . . 0.0 110.874 173.079 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -68.32 -38.96 82.08 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.93 0.492 . . . . 0.0 110.945 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -69.01 -29.18 67.31 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 175.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.495 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -65.24 -59.52 3.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.648 0.779 . . . . 0.0 109.31 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 86.0 t -58.67 -30.88 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.004 0.922 . . . . 0.0 111.076 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.98 -52.84 63.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.12 0.968 . . . . 0.0 111.097 175.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -68.9 -30.05 68.45 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.533 0.733 . . . . 0.0 111.331 -177.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -83.14 -17.46 42.92 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.699 0.8 . . . . 0.0 111.612 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -83.22 -33.76 26.04 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.77 -35.59 72.68 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.718 0.807 . . . . 0.0 110.631 177.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.563 0 C-N-CA 124.4 1.08 . . . . 0.0 108.126 175.597 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 19.7 ttt . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -61.67 -57.73 10.82 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.222 1.009 . . . . 0.0 112.784 -167.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.65 -43.09 99.51 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.558 0.536 . . . . 0.0 110.679 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -67.2 -32.0 72.77 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.048 0.842 . . . . 0.0 111.308 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 24.1 tp -64.83 -45.06 87.72 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.36 -31.24 72.26 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.202 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.3 m -67.66 -42.13 82.67 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.829 0.452 . . . . 0.0 109.939 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' HG3' ' A' ' 68' ' ' LYS . 22.3 t -60.84 -44.57 97.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.352 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 53.6 mt -67.94 -32.18 72.45 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.693 0.62 . . . . 0.0 110.908 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.3 t -64.84 -35.94 82.73 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.857 0.723 . . . . 0.0 111.072 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.2 t -82.92 -25.55 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.898 0.879 . . . . 0.0 110.68 178.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -82.91 -27.56 30.55 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.463 0.705 . . . . 0.0 111.904 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.1 p -107.07 -55.28 2.35 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.056 0.542 . . . . 0.0 110.544 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 130.86 -29.84 3.48 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.47 -178.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 m -79.03 140.9 57.91 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.685 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.515 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 37.7 Cg_endo -63.86 170.53 8.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.108 2.539 . . . . 0.0 113.323 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.21 -22.11 66.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.074 0.95 . . . . 0.0 111.705 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.68 -29.38 66.8 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.105 0.562 . . . . 0.0 110.835 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 11.4 mm-40 -92.5 6.33 47.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.346 0.658 . . . . 0.0 110.755 176.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -127.22 99.23 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.1 0.96 . . . . 0.0 108.821 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.495 ' OG ' ' HB2' ' A' ' 50' ' ' SER . 57.8 p -98.68 150.64 21.57 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -66.68 -24.29 66.25 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.9 0.88 . . . . 0.0 112.2 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -99.68 1.2 43.25 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.912 0.885 . . . . 0.0 111.18 -175.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.495 ' HB2' ' OG ' ' A' ' 47' ' ' SER . 9.0 t -83.35 170.21 14.81 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 123.438 0.695 . . . . 0.0 111.921 -176.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -67.68 147.65 52.38 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.149 165.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.652 ' HG3' ' HB2' ' A' ' 55' ' ' LEU . 19.8 ttt -102.29 -77.73 0.55 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.296 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 38.07 -80.07 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 113.896 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.12 -30.02 64.03 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.052 0.541 . . . . 0.0 112.218 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.652 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 51.1 mt -70.75 -25.5 62.94 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.448 0.699 . . . . 0.0 112.345 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -170.35 96.6 0.25 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.067 0.947 . . . . 0.0 110.766 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -168.07 49.19 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 177.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.402 ' O ' HG23 ' A' ' 62' ' ' VAL . 10.5 t70 -161.94 134.81 6.02 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.986 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.6 p -47.71 -46.7 29.87 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.647 1.179 . . . . 0.0 113.377 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.34 -39.81 74.47 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.588 0.355 . . . . 0.0 110.789 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.31 -34.86 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 123.254 0.347 . . . . 0.0 110.666 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.54 HG13 ' HB2' ' A' ' 82' ' ' LEU . 75.0 t -69.51 -39.06 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.914 0.885 . . . . 0.0 110.203 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.3 m -64.47 -44.58 90.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.402 0.681 . . . . 0.0 110.09 175.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -64.89 -44.84 88.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.28 1.032 . . . . 0.0 110.819 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.0 tp -69.21 -38.7 78.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.036 0.934 . . . . 0.0 110.407 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.0 t -61.13 -38.66 87.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.471 0.709 . . . . 0.0 110.68 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.497 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 94.0 mt -63.55 -48.75 76.21 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.875 0.735 . . . . 0.0 110.625 175.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.506 ' HG3' HG13 ' A' ' 34' ' ' VAL . 75.3 mmtt -59.72 -47.77 84.34 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.093 0.557 . . . . 0.0 111.196 -178.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.58 -29.78 69.22 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.516 0.727 . . . . 0.0 111.347 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.69 -53.06 37.63 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.197 0.999 . . . . 0.0 111.115 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 4.0 mptp? -72.4 -41.54 66.16 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.557 -177.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -82.2 -53.99 5.62 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.303 0.641 . . . . 0.0 112.175 -170.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -107.14 -14.77 14.83 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.157 0.583 . . . . 0.0 112.063 -171.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.28 -6.14 77.46 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 122.908 0.29 . . . . 0.0 112.885 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.577 HG12 HG21 ' A' ' 78' ' ' VAL . 46.0 t -80.93 80.12 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.082 0.953 . . . . 0.0 109.821 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 t -91.32 160.75 15.34 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.28 0.632 . . . . 0.0 111.251 -174.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.49 -110.97 3.15 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.577 HG21 HG12 ' A' ' 75' ' ' VAL . 3.4 t 58.15 26.19 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 125.231 1.412 . . . . 0.0 111.1 173.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -51.37 -57.67 8.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.25 1.42 . . . . 0.0 112.987 -166.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-20 -60.0 -43.49 95.17 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.071 0.857 . . . . 0.0 110.88 -176.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HB2' HG12 ' A' ' 78' ' ' VAL . 38.4 mt-10 -69.77 -40.95 75.77 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.036 0.535 . . . . 0.0 111.105 -173.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.54 ' HB2' HG13 ' A' ' 62' ' ' VAL . 76.6 mt -69.95 -25.16 63.51 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.948 0.499 . . . . 0.0 111.177 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.79 -16.51 31.93 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.181 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 0.3 OUTLIER -99.31 10.31 41.67 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.802 0.841 . . . . 0.0 110.052 -177.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.477 HD11 HD13 ' A' ' 91' ' ' LEU . 24.7 mt -69.29 115.46 8.58 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -173.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -91.23 -53.41 4.37 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.07 -178.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.5 p -127.04 158.41 37.03 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.795 0.838 . . . . 0.0 110.714 -177.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -66.06 -38.55 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -56.46 -34.23 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.328 1.051 . . . . 0.0 111.533 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.2 -40.62 86.49 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.264 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.477 HD13 HD11 ' A' ' 85' ' ' LEU . 63.4 tp -64.1 -34.46 78.08 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 123.673 0.608 . . . . 0.0 111.472 176.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -59.99 -52.53 65.01 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.798 0.439 . . . . 0.0 110.733 174.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -71.72 -19.29 62.07 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.792 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.545 HD21 HG11 ' A' ' 78' ' ' VAL . 8.2 tt -71.74 -57.69 4.14 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.706 0.802 . . . . 0.0 109.106 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.91 -31.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.325 0.65 . . . . 0.0 110.101 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -70.61 -37.71 73.87 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.631 0.773 . . . . 0.0 109.684 174.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.992 0.517 . . . . 0.0 109.822 177.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -72.9 -32.42 65.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.748 0.819 . . . . 0.0 111.25 176.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -66.09 -44.89 83.08 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.614 0.766 . . . . 0.0 110.096 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.58 64.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.286 1.034 . . . . 0.0 110.535 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.74 0 C-N-CA 123.481 0.712 . . . . 0.0 111.144 175.251 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.652 0.263 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.427 ' HG2' ' CE1' ' A' ' 92' ' ' PHE . 9.2 tm-20 -62.37 -39.92 94.76 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.879 0.872 . . . . 0.0 109.857 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -59.16 -50.78 72.73 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.225 0.61 . . . . 0.0 111.119 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 34' ' ' VAL . 34.8 m-70 -64.74 -36.47 84.4 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.267 0.627 . . . . 0.0 110.886 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.48 -37.41 74.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.76 -28.66 63.79 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.997 0.919 . . . . 0.0 110.187 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.6 m -71.98 -42.65 66.26 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.278 1.031 . . . . 0.0 109.952 174.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 30' ' ' HIS . 37.1 t -55.3 -46.14 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 123.567 0.747 . . . . 0.0 109.966 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.403 HD21 HD23 ' A' ' 91' ' ' LEU . 94.7 mt -62.14 -43.49 98.71 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.042 176.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.4 t -65.07 -34.83 79.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.033 0.933 . . . . 0.0 111.892 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.02 -37.45 17.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.481 0.712 . . . . 0.0 109.984 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.85 -26.83 59.97 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.649 0.78 . . . . 0.0 111.861 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.401 ' OG ' HG22 ' A' ' 41' ' ' VAL . 83.8 p -96.46 -41.57 8.52 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.625 0.77 . . . . 0.0 110.68 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.65 -15.11 62.42 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.374 -173.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.401 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -86.76 147.05 42.56 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 123.16 0.584 . . . . 0.0 110.342 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -52.78 155.52 10.59 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.128 2.552 . . . . 0.0 113.956 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -63.57 -26.17 68.57 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.292 0.637 . . . . 0.0 111.139 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.01 -31.14 71.49 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.794 0.838 . . . . 0.0 111.413 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.57 -30.44 64.4 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.511 0.724 . . . . 0.0 110.537 176.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -89.67 97.12 6.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.889 -174.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -79.58 156.92 27.48 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 167.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.401 ' O ' HG23 ' A' ' 88' ' ' VAL . 3.0 mpt_? -68.49 -30.28 69.07 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.22 87.04 6.35 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.2 t -142.83 142.57 31.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.708 0.803 . . . . 0.0 108.898 172.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -85.86 18.24 3.05 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.011 0.924 . . . . 0.0 112.013 -176.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 49.1 mtt 60.72 24.45 14.29 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 124.287 1.035 . . . . 0.0 112.188 176.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -32.92 -58.61 0.36 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 126.286 1.834 . . . . 0.0 113.497 -169.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.72 9.75 4.64 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.389 -0.823 . . . . 0.0 108.901 172.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.03 -42.4 17.53 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.701 0.8 . . . . 0.0 112.028 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -150.5 -1.94 0.38 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -86.31 76.56 9.66 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -179.8 136.3 0.12 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.275 1.43 . . . . 0.0 108.32 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.2 p -58.23 -36.84 73.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.134 0.974 . . . . 0.0 113.144 -173.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.39 -38.37 74.68 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.9 t -71.58 -31.13 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.413 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 66.7 t -69.33 -34.58 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.693 0.797 . . . . 0.0 110.168 174.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.6 t -73.76 -33.72 64.4 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.192 0.597 . . . . 0.0 110.585 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.7 -39.91 84.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.354 0.661 . . . . 0.0 109.538 173.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD11 HD21 ' A' ' 91' ' ' LEU . 59.3 tp -63.22 -51.87 64.5 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.62 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 62.0 p -62.63 -36.32 82.43 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.874 0.87 . . . . 0.0 111.376 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.9 tp -64.95 -41.72 95.25 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.741 0.65 . . . . 0.0 110.854 175.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -69.09 -35.94 77.04 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.289 0.635 . . . . 0.0 111.271 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 88.2 mt -67.75 -32.9 73.82 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.911 0.485 . . . . 0.0 110.038 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -30.88 71.9 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.768 1.227 . . . . 0.0 111.289 175.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -93.59 -61.77 1.49 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.089 0.555 . . . . 0.0 111.335 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -61.6 -47.76 84.0 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.701 1.2 . . . . 0.0 112.063 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -108.64 -18.88 13.61 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 -172.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.2 -13.41 54.92 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-O 120.095 -0.281 . . . . 0.0 113.25 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.61 100.57 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.764 0.826 . . . . 0.0 109.206 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 39.7 m -90.78 141.38 28.87 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.836 0.854 . . . . 0.0 111.794 -169.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.39 -107.72 2.68 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.819 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 81' ' ' GLU . 3.7 t 64.55 15.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.94 1.296 . . . . 0.0 110.883 177.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.64 -28.39 67.19 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.578 1.151 . . . . 0.0 113.457 -166.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -63.27 -51.36 66.47 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 123.68 0.613 . . . . 0.0 110.281 175.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HB2' HG12 ' A' ' 78' ' ' VAL . 4.4 mp0 -68.9 -31.94 71.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.154 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.1 mt -73.17 -18.03 61.31 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -78.34 -35.86 47.02 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.434 0.694 . . . . 0.0 109.596 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.79 2.1 10.95 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.561 0.744 . . . . 0.0 112.499 176.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.625 HD11 HD13 ' A' ' 91' ' ' LEU . 38.8 mt -70.05 140.72 52.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.024 0.529 . . . . 0.0 112.007 172.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.41 -51.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.416 0 O-C-N 124.509 1.131 . . . . 0.0 108.206 170.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.7 p -102.87 149.07 24.87 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.129 0.572 . . . . 0.0 110.679 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 48' ' ' ARG . 4.0 m -67.38 -26.73 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.615 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.52 -45.55 77.11 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.817 . . . . 0.0 110.528 169.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.86 -40.8 85.4 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-N 114.854 -1.067 . . . . 0.0 109.877 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.625 HD13 HD11 ' A' ' 85' ' ' LEU . 47.0 tp -65.87 -39.26 90.53 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.659 0.783 . . . . 0.0 112.425 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CE1' ' HG2' ' A' ' 28' ' ' GLU . 60.4 m-85 -62.06 -36.99 83.32 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.95 -23.13 33.57 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.706 0.802 . . . . 0.0 112.271 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 tt -74.45 -55.37 6.04 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.55 -37.28 74.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.032 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.52 -45.75 84.63 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 123.948 0.78 . . . . 0.0 111.233 173.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -57.85 -48.47 79.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.922 0.889 . . . . 0.0 111.072 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -82.25 -33.83 29.07 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.621 -174.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.08 -42.07 48.49 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.57 -54.07 49.91 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.166 0.587 . . . . 0.0 110.28 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 C-N-CA 124.773 1.229 . . . . 0.0 113.304 173.923 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 ttp . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 119.931 -0.081 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.99 -61.93 1.68 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.899 0.88 . . . . 0.0 112.069 -171.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -65.2 -30.92 71.86 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.704 0.802 . . . . 0.0 110.478 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -63.17 -41.1 99.17 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.741 0.817 . . . . 0.0 109.584 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.506 HD21 ' HG ' ' A' ' 91' ' ' LEU . 39.2 tp -66.69 -38.92 87.75 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.184 0.994 . . . . 0.0 110.003 177.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.5 tp -62.23 -38.74 90.38 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.489 1.116 . . . . 0.0 110.777 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.3 m -66.56 -42.37 87.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.114 0.966 . . . . 0.0 110.684 176.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -57.87 -45.88 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.697 0.799 . . . . 0.0 110.861 177.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 83.5 mt -63.04 -37.94 89.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.519 0.728 . . . . 0.0 111.133 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -61.89 -37.98 86.63 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.509 0.724 . . . . 0.0 111.242 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 56.7 t -79.72 -32.91 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.506 0.723 . . . . 0.0 110.539 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.19 -14.07 58.74 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.757 0.823 . . . . 0.0 111.914 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.463 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 18.4 m -112.24 -38.86 4.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.256 0.622 . . . . 0.0 110.847 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.7 -30.28 10.58 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.008 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.62 137.84 88.33 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.289 0.635 . . . . 0.0 110.364 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.71 161.44 10.06 Favored 'Trans proline' 0 C--N 1.379 2.138 0 C-N-CA 123.46 2.773 . . . . 0.0 113.802 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.92 -29.42 70.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.713 0.805 . . . . 0.0 111.214 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.53 -18.22 64.32 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 111.609 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -89.49 -20.08 24.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.415 0.686 . . . . 0.0 111.175 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.4 mt -102.43 105.04 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.975 0.51 . . . . 0.0 110.892 -174.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.9 p -95.27 -178.02 4.31 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 165.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.73 ' HA ' ' HB ' ' A' ' 88' ' ' VAL . 11.0 ptp180 -84.73 -11.53 55.64 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.596 -0.69 . . . . 0.0 111.25 175.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.99 13.45 28.91 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.607 0.763 . . . . 0.0 110.456 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -85.02 18.34 2.54 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.259 0.624 . . . . 0.0 112.577 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.4 ' O ' HD12 ' A' ' 55' ' ' LEU . 3.8 mmm180 68.12 167.01 0.25 Allowed 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.145 175.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.507 ' HG3' ' HB3' ' A' ' 85' ' ' LEU . 87.9 mmm -121.53 94.47 4.33 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 170.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -137.92 -65.66 0.51 Allowed 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -83.43 -35.14 25.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.245 176.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 70.1 mt -69.69 -44.11 71.1 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.257 -172.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.92 94.95 0.08 Allowed 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.512 1.133 . . . . 0.0 109.68 169.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -163.64 -37.66 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.088 0.955 . . . . 0.0 108.496 175.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -53.98 139.53 34.05 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.046 0.841 . . . . 0.0 110.041 168.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -47.73 -47.29 30.24 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.103 1.361 . . . . 0.0 113.183 -173.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.3 mt -80.36 -25.83 38.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.872 -174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.1 t -77.29 -29.24 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 123.174 0.296 . . . . 0.0 110.207 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.4 t -70.14 -44.68 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.619 0.768 . . . . 0.0 109.897 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.8 p -67.76 -33.58 75.13 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.548 0.53 . . . . 0.0 110.777 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.63 -47.65 74.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.758 0.823 . . . . 0.0 110.422 175.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.8 tp -68.89 -40.48 79.18 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 -174.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 66.5 m -62.6 -48.38 79.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.978 0.511 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.3 tp -57.05 -36.23 70.26 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.865 0.728 . . . . 0.0 110.483 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.0 tppt? -68.61 -52.93 26.11 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.368 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 83.6 mt -52.01 -44.11 63.99 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.11 0.964 . . . . 0.0 111.532 -175.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -61.06 -36.93 80.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.472 1.109 . . . . 0.0 111.92 -174.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -97.92 -64.87 1.0 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.964 0.506 . . . . 0.0 110.905 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.86 -40.62 63.58 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.704 1.602 . . . . 0.0 113.24 -173.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -120.57 -14.79 8.59 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -171.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.85 16.42 79.34 Favored Glycine 0 CA--C 1.534 1.249 0 N-CA-C 113.862 0.305 . . . . 0.0 113.862 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.612 HG21 HG13 ' A' ' 95' ' ' VAL . 59.1 t -93.87 136.16 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 123.86 0.864 . . . . 0.0 108.854 176.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -67.37 156.99 35.13 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 122.736 0.415 . . . . 0.0 111.4 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.16 88.28 0.15 Allowed Glycine 0 C--N 1.357 1.699 0 O-C-N 123.41 0.444 . . . . 0.0 112.994 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.6 m -94.14 47.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.312 1.045 . . . . 0.0 111.226 -174.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -48.12 -39.85 21.76 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.409 1.484 . . . . 0.0 113.963 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.99 -52.45 65.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.335 1.054 . . . . 0.0 110.085 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.11 -25.71 61.85 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -176.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.23 -31.09 70.34 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.856 0.463 . . . . 0.0 110.85 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.53 -26.45 45.75 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.776 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -90.21 12.97 16.42 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.908 0.483 . . . . 0.0 112.22 176.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.528 HD21 HD22 ' A' ' 94' ' ' LEU . 94.1 mt -80.09 148.42 31.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.665 0.386 . . . . 0.0 110.63 172.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -115.47 -55.88 2.4 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.587 0.755 . . . . 0.0 109.858 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.3 p -119.44 163.61 16.99 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.896 0.879 . . . . 0.0 109.637 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 48' ' ' ARG . 11.0 t -69.63 -23.25 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 30.6 t70 -57.12 -48.45 78.62 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.372 0.669 . . . . 0.0 109.739 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -55.75 -39.21 70.85 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.085 0.866 . . . . 0.0 111.265 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.506 ' HG ' HD21 ' A' ' 31' ' ' LEU . 44.4 tp -63.42 -48.45 77.74 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 123.707 0.63 . . . . 0.0 111.601 176.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -60.46 -34.75 74.46 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.363 0.665 . . . . 0.0 110.932 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 16.7 mm100 -75.91 -36.68 59.34 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.608 0.567 . . . . 0.0 110.501 177.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.528 HD22 HD21 ' A' ' 85' ' ' LEU . 26.7 tp -61.2 -53.47 56.46 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.448 0.699 . . . . 0.0 109.748 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.612 HG13 HG21 ' A' ' 75' ' ' VAL . 84.7 t -61.8 -34.73 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.659 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.43 -62.53 1.78 Allowed 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.607 0.763 . . . . 0.0 111.476 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -38.66 90.42 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.881 0.473 . . . . 0.0 111.66 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -74.44 -25.27 59.32 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.308 0.643 . . . . 0.0 112.713 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -88.28 -35.25 17.35 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.549 0.34 . . . . 0.0 110.319 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.93 -31.17 66.08 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.447 0.699 . . . . 0.0 110.77 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.166 0 C-N-CA 124.885 1.274 . . . . 0.0 111.7 -179.108 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.532 ' SD ' HD13 ' A' ' 31' ' ' LEU . 19.4 tmm? . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -59.1 -49.83 76.39 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.066 0.546 . . . . 0.0 110.831 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -49.72 -40.53 40.95 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.345 1.058 . . . . 0.0 111.536 171.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.12 -38.47 69.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.613 0.765 . . . . 0.0 111.287 -173.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.532 HD13 ' SD ' ' A' ' 27' ' ' MET . 11.1 mp -69.75 -33.29 72.23 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 117.973 0.351 . . . . 0.0 110.758 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.34 -33.9 77.06 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.428 0.455 . . . . 0.0 110.41 172.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.9 m -71.88 -39.82 69.36 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.214 0.605 . . . . 0.0 110.337 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.0 t -58.51 -49.63 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.797 0.839 . . . . 0.0 110.042 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.25 -28.3 66.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.628 0.771 . . . . 0.0 111.556 177.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 29.9 t -66.1 -38.17 87.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.842 0.457 . . . . 0.0 111.015 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.2 t -87.17 -30.12 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.09 47.82 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.233 0.613 . . . . 0.0 112.032 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.2 m -108.62 -26.0 10.6 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.184 0.594 . . . . 0.0 111.495 -175.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.49 -27.48 19.35 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-O 119.997 -0.335 . . . . 0.0 112.83 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' SER . 36.0 m -73.0 141.11 81.21 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 123.16 0.584 . . . . 0.0 110.214 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.42 165.63 29.92 Favored 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 122.354 2.036 . . . . 0.0 112.163 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -60.86 -23.31 65.05 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.907 0.883 . . . . 0.0 111.999 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.41 -29.18 65.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.197 0.999 . . . . 0.0 110.887 -176.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -79.66 -11.08 59.87 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.732 0.813 . . . . 0.0 111.343 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.0 mt -110.24 146.78 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.852 0.861 . . . . 0.0 109.743 -174.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.8 p -145.27 157.21 44.11 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 171.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -66.08 -22.51 66.41 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 117.759 0.254 . . . . 0.0 111.145 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -112.07 92.63 4.1 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 171.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -159.34 160.99 35.69 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.317 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmm180 -84.66 129.65 34.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.875 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.418 ' HE3' ' HA ' ' A' ' 88' ' ' VAL . 28.0 mtt -88.58 56.12 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.069 0.948 . . . . 0.0 110.116 174.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.432 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 21.4 mm-40 -71.13 -16.85 62.58 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.827 175.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.92 -30.27 0.53 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.267 1.027 . . . . 0.0 110.737 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -73.79 -10.05 59.27 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.95 33.03 0.15 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.793 0.837 . . . . 0.0 109.311 172.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -99.15 -62.1 1.28 Allowed 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.053 -171.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.501 ' HB3' HG23 ' A' ' 61' ' ' VAL . 34.5 t70 -66.8 152.62 45.19 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.991 0.516 . . . . 0.0 111.704 -176.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 m -52.8 -42.71 65.34 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.107 1.363 . . . . 0.0 112.656 -178.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -67.03 -42.23 85.23 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.834 0.709 . . . . 0.0 110.493 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.501 HG23 ' HB3' ' A' ' 58' ' ' ASP . 21.7 t -64.46 -41.86 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 O-C-N 123.693 0.621 . . . . 0.0 110.482 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.8 t -66.53 -38.95 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.977 0.911 . . . . 0.0 110.503 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.6 t -66.81 -42.38 86.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.726 0.81 . . . . 0.0 110.938 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 41.0 mt-10 -74.48 -33.06 62.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.836 0.854 . . . . 0.0 110.588 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.7 tp -65.19 -41.16 94.82 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.018 0.927 . . . . 0.0 109.734 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.8 t -62.73 -46.42 88.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.118 0.967 . . . . 0.0 110.88 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.79 -30.69 70.95 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.068 -176.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 44.8 mmtm -71.11 -59.71 2.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.783 0.433 . . . . 0.0 110.776 175.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 91' ' ' LEU . 95.9 mt -60.71 -27.6 68.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.526 0.73 . . . . 0.0 112.242 -174.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.14 -56.13 18.74 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.657 1.183 . . . . 0.0 109.683 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -81.47 -40.56 23.09 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.098 -176.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.29 -45.87 53.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.938 0.895 . . . . 0.0 112.152 -166.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.26 -8.74 7.01 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.025 -176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.53 3.64 90.1 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 120.167 -0.24 . . . . 0.0 113.022 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.547 HG12 HG21 ' A' ' 78' ' ' VAL . 59.2 t -81.89 83.8 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.928 0.891 . . . . 0.0 109.239 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -130.53 159.41 37.19 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.766 1.226 . . . . 0.0 109.009 178.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.51 24.73 62.33 Favored Glycine 0 C--N 1.337 0.638 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -167.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.547 HG21 HG12 ' A' ' 75' ' ' VAL . 28.0 m -122.4 17.47 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.299 1.44 . . . . 0.0 109.903 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 82' ' ' LEU . 25.6 t70 -63.96 -31.76 73.06 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.704 0.802 . . . . 0.0 112.063 -170.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -60.91 -48.78 80.24 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.023 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.402 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.1 mt-10 -63.57 -37.18 86.34 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.495 0.718 . . . . 0.0 111.429 178.386 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 79' ' ' ASP . 92.1 mt -62.4 -38.11 88.4 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.002 0.921 . . . . 0.0 111.392 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.28 -24.5 59.27 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.451 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.23 -2.79 58.63 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.699 0.799 . . . . 0.0 111.945 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 70.9 mt -77.74 115.33 17.41 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.041 0.448 . . . . 0.0 110.403 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -116.45 -1.71 12.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.369 1.068 . . . . 0.0 109.945 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 p -143.24 137.81 29.18 Favored 'General case' 0 C--O 1.257 1.484 0 C-N-CA 124.732 1.213 . . . . 0.0 109.608 -176.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.418 ' HA ' ' HE3' ' A' ' 52' ' ' MET . 53.4 t -64.86 -35.38 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 -176.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 34.0 t70 -61.93 -35.25 77.86 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.78 0.432 . . . . 0.0 111.001 179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -68.48 -28.11 66.74 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.811 0.444 . . . . 0.0 111.713 176.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 69' ' ' LEU . 65.7 tp -61.99 -41.0 97.54 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 123.196 0.31 . . . . 0.0 110.616 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.407 ' HD1' ' O ' ' A' ' 88' ' ' VAL . 25.7 m-85 -66.29 -39.47 89.38 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.42 0.688 . . . . 0.0 111.751 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 61.7 mm-40 -69.55 -35.43 75.4 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 78' ' ' VAL . 43.2 tp -58.33 -55.43 35.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.011 0.924 . . . . 0.0 110.456 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.38 -46.46 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.785 -177.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.17 -54.63 43.61 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.658 0.783 . . . . 0.0 112.032 -176.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.23 -43.16 82.67 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.393 0.677 . . . . 0.0 111.506 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -75.83 -18.23 59.54 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.349 0.406 . . . . 0.0 112.057 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -86.34 -28.56 23.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.53 -43.7 63.17 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.352 0.661 . . . . 0.0 110.565 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 124.769 1.228 . . . . 0.0 111.47 178.513 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.3 ptm . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 119.985 -0.055 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.83 -50.33 67.08 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 124.259 1.023 . . . . 0.0 110.826 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -69.17 -31.99 71.01 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 123.683 0.614 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -65.73 -42.52 90.91 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.692 176.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.4 tt -70.68 -32.68 70.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.86 1.264 . . . . 0.0 109.173 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.7 tp -67.75 -36.72 81.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.162 0.985 . . . . 0.0 109.909 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.1 m -69.99 -36.29 75.05 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.15 0.98 . . . . 0.0 110.766 176.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.53 -46.78 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.384 0.674 . . . . 0.0 110.059 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.407 HD21 HD21 ' A' ' 91' ' ' LEU . 98.4 mt -68.33 -28.56 67.26 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.109 0.964 . . . . 0.0 111.606 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -65.4 -53.71 39.23 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.202 0.601 . . . . 0.0 110.249 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.85 -37.03 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.784 -178.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.83 -50.53 66.31 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.107 0.563 . . . . 0.0 111.33 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m -79.68 -21.0 45.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.277 0.631 . . . . 0.0 111.142 -178.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.35 4.77 83.29 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-O 119.769 -0.462 . . . . 0.0 113.6 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.8 m -105.86 149.39 37.95 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.357 1.063 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.523 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 29.7 Cg_endo -61.75 160.16 30.01 Favored 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 122.176 1.917 . . . . 0.0 112.389 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.18 -20.88 65.81 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.582 0.753 . . . . 0.0 111.649 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -68.86 -20.2 64.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.025 0.93 . . . . 0.0 112.109 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.523 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 18.0 mm-40 -82.24 -29.11 31.48 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.21 0.604 . . . . 0.0 110.527 174.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 HD23 ' A' ' 55' ' ' LEU . 6.2 mt -88.71 90.83 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.54 -172.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.3 t -79.22 -0.64 32.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.562 0.745 . . . . 0.0 111.794 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 mtm180 75.15 -35.78 0.29 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 126.465 1.906 . . . . 0.0 112.067 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -76.97 3.1 12.97 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.25 1.02 . . . . 0.0 111.327 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.7 t -54.17 132.67 43.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.399 1.079 . . . . 0.0 110.825 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -91.99 31.35 1.26 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.773 0.829 . . . . 0.0 111.446 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.753 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 17.0 mmt 62.86 15.94 8.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.147 0.979 . . . . 0.0 112.694 174.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.66 -46.16 89.86 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.475 0.71 . . . . 0.0 112.32 -168.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -124.9 5.45 8.03 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.936 0.894 . . . . 0.0 109.972 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.426 HD23 HG12 ' A' ' 46' ' ' ILE . 3.5 mp -123.65 122.02 37.05 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.277 0.631 . . . . 0.0 110.235 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.612 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 74.2 -28.93 0.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.753 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 50.4 t80 -82.56 -19.45 38.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.539 0.736 . . . . 0.0 112.731 -169.333 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.86 136.18 57.93 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.703 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.9 m -54.36 -39.66 67.37 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.654 0.782 . . . . 0.0 113.084 -170.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.3 -42.27 93.23 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.39 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 27.2 t -74.99 -23.28 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.402 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.2 t -71.58 -34.03 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 172.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.1 m -69.94 -31.71 69.59 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.467 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -77.33 -29.12 53.35 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.43 0.692 . . . . 0.0 111.224 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -48.05 58.45 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.411 0.685 . . . . 0.0 109.35 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 26.9 p -61.81 -39.0 90.23 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.281 176.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.2 tp -57.62 -52.15 66.58 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.685 0.794 . . . . 0.0 111.325 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -68.78 -61.7 1.7 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.495 -175.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.6 mt -51.69 -35.68 43.65 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.78 0.675 . . . . 0.0 111.89 -176.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 66' ' ' SER . 60.8 ttt180 -55.81 -44.42 77.84 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.004 1.322 . . . . 0.0 112.816 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -100.17 -54.61 2.83 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.191 0.596 . . . . 0.0 111.619 -178.056 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -51.99 -48.7 64.3 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.239 1.416 . . . . 0.0 112.413 -176.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -116.59 -12.2 10.97 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.208 0.603 . . . . 0.0 111.884 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.44 -11.22 59.27 Favored Glycine 0 N--CA 1.473 1.161 0 CA-C-O 120.046 -0.308 . . . . 0.0 113.465 -176.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.672 HG21 HG13 ' A' ' 95' ' ' VAL . 50.6 t -71.7 92.52 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 124.514 1.125 . . . . 0.0 109.989 -174.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -117.66 166.1 12.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.272 0.629 . . . . 0.0 110.936 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.22 65.79 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.575 0.547 . . . . 0.0 113.027 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.408 HG11 HG12 ' A' ' 75' ' ' VAL . 27.3 m -98.8 8.94 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.086 0.955 . . . . 0.0 111.75 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' A' ' 82' ' ' LEU . 6.8 p-10 -58.38 -33.38 69.54 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.622 1.169 . . . . 0.0 111.509 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -58.71 -57.83 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.68 1.192 . . . . 0.0 110.958 175.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG3' HD11 ' A' ' 94' ' ' LEU . 9.6 pt-20 -77.42 -19.66 55.76 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.03 -174.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 79' ' ' ASP . 34.8 mt -64.41 -39.64 94.25 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.046 0.938 . . . . 0.0 110.233 169.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -67.84 -35.65 78.96 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.484 173.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.51 -4.21 47.46 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.481 0.712 . . . . 0.0 112.744 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 91' ' ' LEU . 87.4 mt -74.91 140.69 43.96 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.776 0.43 . . . . 0.0 111.476 177.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.36 -0.1 5.68 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.222 1.009 . . . . 0.0 109.666 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p -155.09 140.03 17.3 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.305 1.042 . . . . 0.0 110.868 -170.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.3 t -75.77 -33.2 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.025 0.93 . . . . 0.0 111.329 -174.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.58 -38.31 87.09 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.155 0.502 . . . . 0.0 110.705 176.095 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.29 -29.48 68.27 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.962 0.905 . . . . 0.0 111.528 174.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.505 ' HB2' HD13 ' A' ' 85' ' ' LEU . 33.7 tp -66.72 -38.72 87.27 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.647 0.379 . . . . 0.0 111.553 171.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -61.39 -48.1 82.8 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 174.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -62.85 -30.02 71.19 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.702 0.801 . . . . 0.0 112.447 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' A' ' 81' ' ' GLU . 7.1 tt -61.27 -58.18 9.31 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.385 1.074 . . . . 0.0 109.206 175.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 HG21 ' A' ' 75' ' ' VAL . 96.4 t -63.92 -40.37 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.966 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.69 -35.78 80.94 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.711 0.804 . . . . 0.0 111.309 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -66.71 -46.6 75.01 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -72.09 -24.31 61.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.715 0.806 . . . . 0.0 111.456 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.3 -34.0 59.07 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.05 -18.91 38.03 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.543 0.737 . . . . 0.0 111.354 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.442 0 C-N-CA 125.291 1.437 . . . . 0.0 112.059 -172.523 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.973 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.42 -46.35 90.31 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 124.11 0.964 . . . . 0.0 111.423 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.13 -37.32 87.06 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.807 0.692 . . . . 0.0 110.469 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.471 ' O ' HG23 ' A' ' 34' ' ' VAL . 27.5 m170 -72.89 -30.36 63.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.455 0.702 . . . . 0.0 110.734 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.48 -34.65 65.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.151 0.98 . . . . 0.0 108.848 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.15 -31.81 70.73 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.579 175.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.5 m -70.13 -38.84 75.63 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.004 0.922 . . . . 0.0 110.243 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 30' ' ' HIS . 67.5 t -57.87 -50.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.207 0.603 . . . . 0.0 109.713 174.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 81.9 mt -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.005 0.922 . . . . 0.0 112.078 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.4 t -64.26 -48.58 75.2 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.132 0.573 . . . . 0.0 110.661 178.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -77.97 -23.18 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.862 0.865 . . . . 0.0 110.841 -177.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.52 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -79.38 -42.89 24.55 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.435 0.694 . . . . 0.0 111.014 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.3 p -80.52 -53.58 6.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.391 0.676 . . . . 0.0 110.593 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.3 -23.57 6.79 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.853 -174.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.2 m -87.14 149.83 48.26 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 123.582 0.753 . . . . 0.0 109.764 176.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.473 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 69.6 Cg_endo -71.22 165.88 31.01 Favored 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 122.394 2.063 . . . . 0.0 112.164 179.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.15 -26.97 66.7 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.714 0.806 . . . . 0.0 111.406 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.04 -33.33 75.21 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.643 0.777 . . . . 0.0 111.739 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 13.2 mm-40 -84.91 -18.86 33.36 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.241 0.616 . . . . 0.0 111.734 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.9 mt -97.6 154.19 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.78 0.832 . . . . 0.0 109.66 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 t -155.68 177.13 11.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -59.07 -40.99 86.91 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -79.99 81.34 6.27 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.458 -1.246 . . . . 0.0 108.497 176.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.1 t -162.1 113.95 1.68 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-N 114.278 -1.328 . . . . 0.0 108.388 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -68.37 108.66 3.32 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.54 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 50.6 ttm -73.47 76.55 1.43 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.206 1.402 . . . . 0.0 110.461 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -123.72 16.32 9.48 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.974 0.909 . . . . 0.0 109.852 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -157.55 -44.68 0.07 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.456 1.102 . . . . 0.0 109.663 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.409 ' H ' HD12 ' A' ' 55' ' ' LEU . 5.0 mp -69.51 -30.26 68.08 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.927 -170.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -154.84 39.37 0.43 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.238 0.615 . . . . 0.0 110.374 179.451 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -106.83 -30.96 8.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.855 -176.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.53 140.84 58.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.398 0.679 . . . . 0.0 110.738 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -54.14 -43.54 70.63 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.179 0.992 . . . . 0.0 113.464 -173.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 tt -68.36 -39.0 81.95 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.52 HG13 ' HB1' ' A' ' 38' ' ' ALA . 36.4 t -69.34 -32.9 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 122.984 0.514 . . . . 0.0 111.243 -179.152 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.9 -40.47 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.246 0.618 . . . . 0.0 109.816 175.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 33.7 m -64.89 -47.64 77.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.031 176.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.21 -41.18 83.45 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.706 1.202 . . . . 0.0 110.482 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.466 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 40.8 tp -64.66 -50.98 64.94 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.29 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -55.48 -47.58 75.91 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.012 0.925 . . . . 0.0 111.966 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 63' ' ' SER . 87.9 mt -66.39 -35.53 80.57 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.457 0.703 . . . . 0.0 111.27 -178.245 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -73.42 -40.98 63.83 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 123.64 0.587 . . . . 0.0 110.468 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.0 mt -65.9 -36.34 83.12 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.579 0.752 . . . . 0.0 110.2 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 ttp85 -62.46 -51.0 69.23 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.553 1.141 . . . . 0.0 110.966 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -49.37 51.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.466 -174.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -88.15 -53.54 4.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.567 0.747 . . . . 0.0 111.53 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 69' ' ' LEU . 92.8 m-85 -94.59 -13.54 25.86 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.31 0.644 . . . . 0.0 112.155 -171.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.1 5.05 90.02 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 116.915 -0.129 . . . . 0.0 113.106 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.44 HG21 HG13 ' A' ' 95' ' ' VAL . 75.9 t -81.95 111.29 18.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.036 0.934 . . . . 0.0 109.512 -179.081 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.7 p -62.52 171.55 1.93 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.089 0.955 . . . . 0.0 112.293 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.7 92.49 0.01 OUTLIER Glycine 0 C--N 1.358 1.755 0 O-C-N 124.147 0.904 . . . . 0.0 113.353 -177.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 8.9 m -104.39 37.61 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.371 1.068 . . . . 0.0 110.663 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.55 -41.31 66.33 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.429 1.092 . . . . 0.0 112.29 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -62.93 -44.7 95.35 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.77 0.828 . . . . 0.0 110.609 176.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 25.7 mm-40 -64.92 -31.88 73.33 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.955 178.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 76.0 mt -71.73 -36.72 70.56 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.168 0.587 . . . . 0.0 111.731 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -75.83 -23.2 55.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 110.661 -0.126 . . . . 0.0 110.661 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 81' ' ' GLU . 89.6 mt -68.55 -19.55 64.5 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.3 0.64 . . . . 0.0 111.882 171.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 29.3 mt -82.6 150.66 26.74 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.956 0.503 . . . . 0.0 110.111 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -136.12 -6.1 2.09 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.044 0.938 . . . . 0.0 109.594 175.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.2 m -141.64 154.32 45.3 Favored 'General case' 0 C--O 1.246 0.897 0 C-N-CA 123.027 0.531 . . . . 0.0 110.277 -174.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.04 -32.12 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 123.727 0.811 . . . . 0.0 111.42 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.67 -49.44 67.98 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.074 0.55 . . . . 0.0 110.72 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.01 -37.74 83.6 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.295 -176.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.5 tp -67.29 -47.87 69.33 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.358 0.412 . . . . 0.0 111.848 176.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -59.59 -43.84 93.57 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.556 0.742 . . . . 0.0 111.778 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.7 -31.21 57.08 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.14 0.275 . . . . 0.0 111.479 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.15 -51.23 68.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.984 0.513 . . . . 0.0 110.403 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.44 HG13 HG21 ' A' ' 75' ' ' VAL . 81.1 t -65.47 -42.02 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.847 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -63.65 -45.78 88.6 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 123.672 0.607 . . . . 0.0 111.373 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -73.82 -28.23 61.51 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.212 0.605 . . . . 0.0 111.49 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -81.33 -19.97 41.68 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.681 0.392 . . . . 0.0 110.789 175.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -81.78 -30.63 32.24 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 174.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.5 -30.56 29.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.812 0.845 . . . . 0.0 110.668 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.781 0 C-N-CA 124.07 0.948 . . . . 0.0 108.798 178.424 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.05 80.82 1.55 Allowed Glycine 0 C--N 1.344 1.006 0 O-C-N 123.318 0.386 . . . . 0.0 112.192 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.1 p -163.51 145.88 9.8 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.166 0.986 . . . . 0.0 109.215 178.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 t -156.09 58.9 0.59 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -68.33 123.8 21.76 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.495 -174.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -146.87 115.48 6.76 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.581 1.153 . . . . 0.0 107.93 174.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -114.31 39.63 2.72 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.193 0.597 . . . . 0.0 109.641 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 t60 -59.06 126.83 29.3 Favored 'General case' 0 C--N 1.357 0.916 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.738 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -102.2 134.14 45.93 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.954 0.902 . . . . 0.0 108.832 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -65.86 -35.77 81.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 123.58 0.55 . . . . 0.0 110.693 177.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.2 m 71.31 124.82 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 125.289 1.435 . . . . 0.0 110.83 -176.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.4 p -147.95 34.85 0.83 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.417 1.087 . . . . 0.0 109.562 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.82 100.83 0.22 Allowed Glycine 0 C--N 1.357 1.697 0 CA-C-N 115.196 -0.911 . . . . 0.0 113.013 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -136.76 139.57 41.94 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 124.166 0.986 . . . . 0.0 108.393 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -161.35 99.14 1.16 Allowed 'General case' 0 C--O 1.241 0.619 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -177.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -164.89 100.91 0.77 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.5 mp -115.05 116.57 28.65 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.654 0.782 . . . . 0.0 109.778 -174.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -124.4 160.22 28.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.154 0.982 . . . . 0.0 109.785 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -105.03 20.76 18.29 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 109.982 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.87 93.22 0.96 Allowed 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.603 0.761 . . . . 0.0 110.447 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -153.67 19.3 0.68 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.951 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -110.77 126.33 54.48 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.188 0.995 . . . . 0.0 109.004 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 88.2 mtp 59.47 81.24 0.25 Allowed Pre-proline 0 CA--C 1.555 1.155 0 O-C-N 124.635 1.209 . . . . 0.0 111.546 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.12 80.22 2.51 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 122.44 2.093 . . . . 0.0 110.342 174.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.7 -45.71 77.8 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.482 1.113 . . . . 0.0 110.982 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -90.25 96.89 10.88 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.914 175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.6 ttt -55.64 -40.82 72.7 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.894 170.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.31 -41.39 88.91 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 124.51 1.131 . . . . 0.0 111.539 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.68 -45.29 93.47 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.139 0.576 . . . . 0.0 110.721 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -70.3 -33.48 71.6 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.725 0.641 . . . . 0.0 110.696 -175.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.03 -36.31 61.9 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.899 0.88 . . . . 0.0 108.716 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.62 -32.74 74.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.283 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.522 ' HA ' ' HE3' ' A' ' 43' ' ' LYS . 77.9 m -72.57 -38.25 67.97 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.866 0.866 . . . . 0.0 110.627 176.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.29 -45.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.393 0.677 . . . . 0.0 110.127 172.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 71.6 mt -68.82 -37.15 79.01 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.093 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.5 t -67.98 -29.36 68.37 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.375 0.67 . . . . 0.0 111.448 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.4 t -85.23 -43.11 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 123.439 0.696 . . . . 0.0 110.272 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.9 -43.72 87.34 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.534 0.734 . . . . 0.0 111.222 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 13.6 m -81.41 -30.44 33.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.849 0.859 . . . . 0.0 110.169 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.07 -11.29 65.48 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.397 -0.365 . . . . 0.0 113.331 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 33.4 m -91.15 145.16 31.05 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 123.842 0.857 . . . . 0.0 110.61 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -54.88 169.91 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.852 3.034 . . . . 0.0 115.432 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 33' ' ' THR . 44.5 mmtm -60.25 -34.92 74.37 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.115 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.85 -30.95 71.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.314 0.646 . . . . 0.0 111.571 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.55 -4.29 55.6 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mt -127.34 133.29 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.278 0.631 . . . . 0.0 109.507 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.6 t -135.51 167.83 20.36 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.586 0.754 . . . . 0.0 109.44 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -64.38 -55.68 19.45 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.75 89.82 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -170.31 154.26 4.76 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.197 -1.365 . . . . 0.0 108.457 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -94.25 153.34 18.09 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 123.79 0.836 . . . . 0.0 109.472 177.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.687 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 20.0 mmt -73.59 97.17 2.57 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.87 -121.61 0.26 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.374 1.069 . . . . 0.0 108.514 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -85.25 54.46 3.11 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 122.717 1.246 . . . . 0.0 109.25 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.4 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 87.2 mt -127.79 -46.41 1.42 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.778 -176.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.71 21.7 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.426 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.687 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 49.0 t80 -122.58 75.85 1.29 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 121.965 0.888 . . . . 0.0 110.023 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.5 t70 179.55 135.74 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 113.506 -1.679 . . . . 0.0 107.16 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.3 p -52.03 -39.21 59.18 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.893 0.877 . . . . 0.0 113.118 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -68.09 -47.86 67.09 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.764 0.426 . . . . 0.0 110.677 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.47 -28.18 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 -176.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.9 t -74.75 -38.27 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.753 0.821 . . . . 0.0 109.86 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -68.07 -35.28 77.95 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.918 0.487 . . . . 0.0 110.525 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 10.5 tp10 -70.84 -42.92 69.53 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.388 0.675 . . . . 0.0 109.922 176.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 56' ' ' ALA . 56.0 tp -61.29 -48.43 81.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.305 1.042 . . . . 0.0 110.502 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 32.6 t -57.96 -47.64 82.33 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.134 0.974 . . . . 0.0 109.593 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 45.0 tp -53.29 -40.61 64.84 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.15 0.98 . . . . 0.0 111.22 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 71.9 mmtt -65.81 -55.11 18.85 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.566 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.454 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 97.7 mt -56.68 -32.14 65.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.082 0.953 . . . . 0.0 112.588 -173.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 66' ' ' SER . 45.7 mtm180 -59.75 -37.06 77.94 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.493 0.717 . . . . 0.0 111.044 178.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -93.91 -49.22 5.91 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.863 0.865 . . . . 0.0 111.239 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.59 -40.66 69.75 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.768 0.827 . . . . 0.0 111.83 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -125.5 -6.11 7.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.128 0.571 . . . . 0.0 111.909 -175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 75.78 3.6 73.96 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 113.609 0.204 . . . . 0.0 113.609 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.649 HG21 HG13 ' A' ' 95' ' ' VAL . 75.1 t -77.91 98.81 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.991 0.916 . . . . 0.0 109.679 -176.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 25.3 m -123.45 149.69 44.77 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.976 0.911 . . . . 0.0 110.168 -172.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.58 15.25 80.62 Favored Glycine 0 C--N 1.354 1.552 0 O-C-N 123.436 0.46 . . . . 0.0 113.827 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 15.9 m -92.05 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.166 0.986 . . . . 0.0 112.225 -173.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -54.42 -45.62 73.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.123 0.969 . . . . 0.0 111.938 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -65.5 -38.42 89.66 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 124.161 0.913 . . . . 0.0 110.982 -178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.472 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 5.1 mp0 -65.85 -40.38 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.248 1.019 . . . . 0.0 110.947 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.432 ' HA ' ' HG ' ' A' ' 85' ' ' LEU . 85.6 mt -76.01 -25.24 55.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 110.784 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.06 -28.34 62.26 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.061 0.944 . . . . 0.0 110.424 173.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -90.95 10.18 27.56 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.319 1.048 . . . . 0.0 112.35 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.613 HD13 ' HE3' ' A' ' 52' ' ' MET . 78.9 mt -79.53 126.99 31.58 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.89 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -126.73 -45.95 1.59 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.412 1.085 . . . . 0.0 108.083 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 35.5 p -115.61 154.86 28.68 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.816 0.817 . . . . 0.0 110.767 172.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.423 HG12 ' HE2' ' A' ' 92' ' ' PHE . 53.0 t -70.74 -36.82 66.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.115 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.71 -37.77 82.79 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.229 0.611 . . . . 0.0 110.56 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.27 -39.06 85.5 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 124.05 0.844 . . . . 0.0 110.854 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.434 HD13 HD11 ' A' ' 85' ' ' LEU . 44.3 tp -62.71 -42.36 99.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 123.401 0.438 . . . . 0.0 111.397 174.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.423 ' HE2' HG12 ' A' ' 88' ' ' VAL . 71.1 m-85 -59.57 -45.3 92.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.987 0.515 . . . . 0.0 110.638 175.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.15 -31.82 70.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.016 0.927 . . . . 0.0 111.445 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tt -70.22 -55.82 8.34 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.789 0.836 . . . . 0.0 109.653 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.649 HG13 HG21 ' A' ' 75' ' ' VAL . 59.6 t -64.49 -29.19 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 O-C-N 124.076 0.86 . . . . 0.0 110.15 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -61.53 -54.17 46.72 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.077 0.951 . . . . 0.0 110.175 173.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -69.41 -27.19 65.07 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.741 0.816 . . . . 0.0 111.308 -178.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -79.23 -32.29 43.88 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.927 0.891 . . . . 0.0 110.22 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -74.23 -41.09 61.91 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.475 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.47 97.29 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.706 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 62.02 -170.75 0.16 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 125.367 1.467 . . . . 0.0 112.295 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -109.24 12.73 33.79 Favored Glycine 0 C--N 1.347 1.148 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.356 174.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.793 0.837 . . . . 0.0 109.449 179.909 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -86.72 9.26 72.21 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.675 0.609 . . . . 0.0 113.383 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.6 m -64.73 90.24 0.08 Allowed 'General case' 0 C--N 1.355 0.817 0 C-N-CA 124.217 1.007 . . . . 0.0 110.025 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -157.72 94.85 1.38 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.551 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -76.99 169.19 18.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.24 0.616 . . . . 0.0 109.484 173.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -76.72 154.9 33.69 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -144.21 151.84 40.04 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 108.662 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -122.73 167.86 12.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.928 0.891 . . . . 0.0 109.473 -177.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -124.72 161.4 26.45 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.975 0.91 . . . . 0.0 110.109 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -154.19 130.8 10.68 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.189 0.996 . . . . 0.0 109.207 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.0 p -111.79 144.73 40.61 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.212 1.005 . . . . 0.0 109.637 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.3 p -74.4 -22.91 58.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.864 0.865 . . . . 0.0 111.478 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.05 -145.92 43.81 Favored Glycine 0 C--N 1.353 1.512 0 O-C-N 123.731 0.645 . . . . 0.0 111.515 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -162.39 134.28 5.41 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.292 0.637 . . . . 0.0 109.796 172.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -82.94 -25.34 32.47 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.969 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -71.51 104.57 3.31 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -135.37 -178.37 5.08 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.265 1.026 . . . . 0.0 110.055 -176.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 66.75 87.65 0.12 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.994 1.318 . . . . 0.0 111.386 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -110.35 10.97 23.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.667 0.787 . . . . 0.0 110.841 173.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -70.69 110.86 5.75 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.563 0.745 . . . . 0.0 109.845 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.04 -92.05 0.37 Allowed Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -170.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.5 m80 -135.02 -89.33 0.34 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 170.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 28.0 ttt -171.72 87.12 0.45 Allowed Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -78.51 155.15 27.94 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 122.683 2.255 . . . . 0.0 112.501 -177.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 60.64 89.01 0.08 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.464 1.106 . . . . 0.0 111.642 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -86.71 78.86 9.03 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -134.05 -60.0 0.82 Allowed 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.316 0.646 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.485 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 45.3 tt0 -73.16 -64.26 1.01 Allowed 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -171.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.07 -34.02 74.24 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.81 0.844 . . . . 0.0 110.115 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.6 t-160 -63.55 -42.8 98.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.094 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 91' ' ' LEU . 33.6 tp -74.36 -33.07 62.99 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.519 0.512 . . . . 0.0 110.959 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.6 -28.78 69.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.329 0.252 . . . . 0.0 110.874 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.3 m -72.41 -43.77 63.4 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.827 0.451 . . . . 0.0 110.297 172.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.6 t -54.87 -44.49 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.705 0.802 . . . . 0.0 110.567 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.12 -42.51 80.08 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.348 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.9 p -65.79 -34.74 78.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.729 0.299 . . . . 0.0 111.53 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.28 -36.79 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 C-N-CA 123.497 0.719 . . . . 0.0 110.83 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.32 -36.93 45.75 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.873 0.469 . . . . 0.0 112.038 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 m -87.23 -55.16 3.94 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.925 0.89 . . . . 0.0 110.33 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.5 -24.74 7.96 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.738 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.6 m -76.29 131.26 75.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 122.912 0.485 . . . . 0.0 110.041 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.479 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 25.5 Cg_endo -61.27 161.74 22.34 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.683 2.256 . . . . 0.0 112.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -59.39 -26.06 64.81 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 124.874 1.27 . . . . 0.0 112.467 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -68.38 -24.46 64.78 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.942 0.897 . . . . 0.0 111.369 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.479 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 12.9 mm-40 -85.92 -19.1 31.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.684 0.793 . . . . 0.0 110.92 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.3 mt -99.62 133.75 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.601 0.761 . . . . 0.0 110.33 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 t -121.86 168.55 11.73 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.861 0.864 . . . . 0.0 109.136 172.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -73.34 -20.55 60.76 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.926 0.491 . . . . 0.0 111.832 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.97 1.07 30.74 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.801 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.5 t -65.32 152.14 44.52 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.203 0.601 . . . . 0.0 111.942 -171.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -73.87 160.47 31.38 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.616 0.767 . . . . 0.0 110.606 175.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.676 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 17.4 mmt -104.9 26.67 8.92 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.063 0.945 . . . . 0.0 110.805 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.05 -61.65 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.165 0.507 . . . . 0.0 110.468 -170.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -94.07 -16.16 24.08 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.1 mp -85.61 -17.08 37.22 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.184 0.994 . . . . 0.0 112.278 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -156.42 -152.82 0.39 Allowed 'General case' 0 C--O 1.246 0.908 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 62.56 61.79 1.19 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.445 1.098 . . . . 0.0 112.125 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -177.03 137.52 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 113.197 -1.819 . . . . 0.0 106.918 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.7 m -56.47 -35.44 67.94 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.745 0.653 . . . . 0.0 111.752 -175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -81.48 -38.48 26.28 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.958 0.503 . . . . 0.0 110.822 -174.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.36 -39.71 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 121.372 0.606 . . . . 0.0 110.752 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.544 HG13 ' HB2' ' A' ' 82' ' ' LEU . 56.1 t -72.8 -31.3 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.567 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.5 t -69.03 -33.77 74.16 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.688 0.395 . . . . 0.0 110.309 173.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -70.49 -40.4 73.63 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.158 0.983 . . . . 0.0 110.035 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 38.6 tp -74.36 -35.21 63.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.946 0.899 . . . . 0.0 111.246 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.3 p -72.49 -40.78 66.63 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.845 0.458 . . . . 0.0 109.938 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.0 tp -58.3 -38.76 77.7 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 124.181 0.925 . . . . 0.0 110.466 171.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -64.03 -57.97 8.08 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.469 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.413 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 91.2 mt -62.16 -36.27 81.33 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.579 0.752 . . . . 0.0 111.471 -177.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -56.18 -42.73 77.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.827 1.251 . . . . 0.0 110.886 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -86.66 -32.65 20.42 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.261 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -90.42 -55.04 3.74 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.962 0.505 . . . . 0.0 111.786 -165.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -110.73 -1.83 16.5 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.847 0.859 . . . . 0.0 110.813 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.12 7.13 86.71 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.126 0.393 . . . . 0.0 113.245 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 42.4 t -81.92 95.02 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 123.597 0.759 . . . . 0.0 109.68 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.5 m -111.12 155.25 23.13 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.295 1.038 . . . . 0.0 111.322 -171.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.53 80.45 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 116.583 -0.28 . . . . 0.0 113.491 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 30.3 m -93.07 16.1 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.913 0.885 . . . . 0.0 111.551 -176.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -54.87 -52.48 62.69 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.139 0.975 . . . . 0.0 111.042 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -57.29 -42.91 82.6 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 24.1 mm-40 -60.55 -37.21 80.5 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.23 0.612 . . . . 0.0 111.421 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.544 ' HB2' HG13 ' A' ' 62' ' ' VAL . 87.3 mt -66.18 -35.29 80.06 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.956 0.902 . . . . 0.0 111.226 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -58.86 -43.0 90.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.698 172.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.7 -21.04 61.83 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 82.8 mt -76.76 126.78 31.56 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.53 0.332 . . . . 0.0 110.667 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -102.96 -26.75 12.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.525 0.73 . . . . 0.0 111.107 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 37.0 p -131.4 164.19 26.24 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.408 0.623 . . . . 0.0 111.263 -178.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 85.7 t -69.3 -36.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.016 -176.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.13 -29.27 68.14 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.977 0.511 . . . . 0.0 111.54 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HB3' HD22 ' A' ' 85' ' ' LEU . 47.1 mt-10 -66.5 -39.44 88.71 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.608 0.363 . . . . 0.0 110.476 171.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.499 ' HG ' HD21 ' A' ' 31' ' ' LEU . 37.5 tp -62.76 -42.78 99.84 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.983 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.1 m-85 -57.95 -58.24 9.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.436 0.694 . . . . 0.0 111.328 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -64.07 -24.88 67.87 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.443 0.464 . . . . 0.0 111.533 -176.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.6 tp -69.94 -50.04 45.92 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.293 0.371 . . . . 0.0 110.305 175.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 89.6 t -58.58 -44.99 90.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.056 0.542 . . . . 0.0 110.326 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -67.44 -46.74 72.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.83 0.852 . . . . 0.0 111.895 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -63.23 -56.13 19.11 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.495 0.718 . . . . 0.0 110.589 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -65.95 -22.27 66.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.367 1.067 . . . . 0.0 112.0 -175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -68.94 -56.95 6.26 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.266 0.626 . . . . 0.0 110.261 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -88.35 -62.41 1.5 Allowed 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.348 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.68 84.91 5.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.6 0.76 . . . . 0.0 110.027 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.45 3.34 Favored Glycine 0 CA--C 1.536 1.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.975 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 36.6 p . . . . . 0 C--O 1.253 1.237 0 C-N-CA 124.026 0.93 . . . . 0.0 109.353 -179.126 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.2 mtm . . . . . 0 N--CA 1.484 1.226 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.15 11.06 53.72 Favored Glycine 0 C--N 1.347 1.188 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.969 176.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.2 p -81.47 74.6 8.46 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.6 0.714 . . . . 0.0 110.584 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 m -87.36 118.25 26.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.336 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -136.31 93.75 2.93 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -98.06 99.01 10.25 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.741 0.816 . . . . 0.0 109.424 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -79.85 118.37 21.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.612 0.765 . . . . 0.0 109.596 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -155.06 115.21 3.8 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.143 0.577 . . . . 0.0 109.611 176.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -143.34 120.53 11.5 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.083 0.953 . . . . 0.0 108.845 175.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.1 t60 -149.57 84.23 1.42 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.076 0.95 . . . . 0.0 108.567 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 p -110.3 132.55 54.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.649 0.78 . . . . 0.0 110.065 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.6 p -161.4 -62.43 0.05 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.21 1.004 . . . . 0.0 109.151 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 82.07 137.41 2.51 Favored Glycine 0 C--N 1.347 1.16 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.749 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -83.73 -48.84 9.7 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.86 0.864 . . . . 0.0 109.872 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -90.9 82.63 5.64 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.177 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.27 149.84 25.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.746 0.819 . . . . 0.0 110.306 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.4 mt 64.26 -177.97 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.784 1.233 . . . . 0.0 112.823 173.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -147.48 107.23 3.96 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.592 0.757 . . . . 0.0 109.557 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -107.58 98.12 7.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -120.12 82.86 1.96 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.844 0.858 . . . . 0.0 109.919 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.94 -42.56 6.7 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.31 -178.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -75.63 98.49 4.05 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.456 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . 21.6 ptt? -148.48 91.27 4.75 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 123.839 0.856 . . . . 0.0 109.473 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -79.96 8.72 3.9 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 123.165 2.577 . . . . 0.0 113.991 -174.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 23' ' ' MET . 8.9 p30 -72.06 -47.08 54.2 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.301 0.641 . . . . 0.0 111.499 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.0 t70 53.25 71.56 0.49 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.332 1.053 . . . . 0.0 109.734 -173.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -170.62 -55.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.777 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.38 -41.44 89.38 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.612 0.765 . . . . 0.0 111.349 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -74.22 -29.91 61.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.947 1.299 . . . . 0.0 110.814 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.426 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.1 t60 -70.79 -48.72 52.72 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.702 0.801 . . . . 0.0 109.792 -178.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.524 HD23 ' HG ' ' A' ' 91' ' ' LEU . 8.1 mp -62.62 -35.98 81.29 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.265 0.978 . . . . 0.0 110.384 175.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -61.19 -39.5 90.4 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.915 0.886 . . . . 0.0 110.905 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.4 m -70.23 -39.76 74.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.896 0.878 . . . . 0.0 110.977 175.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.513 HG13 ' HG2' ' A' ' 68' ' ' LYS . 64.5 t -59.77 -48.41 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.367 0.667 . . . . 0.0 110.553 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.32 -31.5 71.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.722 0.809 . . . . 0.0 111.256 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 t -61.72 -43.21 99.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.306 0.642 . . . . 0.0 111.356 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.6 t -79.07 -46.03 23.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.036 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.5 -43.27 73.46 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.852 0.861 . . . . 0.0 112.085 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 m -91.8 -15.35 28.38 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.156 0.582 . . . . 0.0 111.617 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.12 21.5 70.51 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 114.239 0.455 . . . . 0.0 114.239 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.47 152.76 42.91 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 124.245 1.018 . . . . 0.0 110.442 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.76 151.92 45.19 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.506 2.137 . . . . 0.0 112.384 165.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.75 -26.41 68.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.756 0.822 . . . . 0.0 111.32 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -75.28 -19.98 59.39 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.138 0.975 . . . . 0.0 111.573 -176.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.59 -36.59 73.64 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.551 0.691 . . . . 0.0 109.487 176.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG23 HG21 ' A' ' 88' ' ' VAL . 47.9 mt -91.18 89.65 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.827 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -94.18 26.49 3.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.715 0.806 . . . . 0.0 110.669 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.16 -48.17 0.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.136 1.774 . . . . 0.0 110.302 -168.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.28 82.35 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.595 0.758 . . . . 0.0 109.683 164.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB2' HG21 ' A' ' 88' ' ' VAL . 48.8 m -160.57 153.76 21.74 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.548 1.139 . . . . 0.0 109.127 -177.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -101.58 135.95 42.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.058 0.943 . . . . 0.0 109.953 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.526 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 71.9 mmm -81.54 6.41 14.96 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.963 0.505 . . . . 0.0 111.644 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.81 -30.95 71.17 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.491 0.716 . . . . 0.0 111.265 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.44 -43.67 6.81 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.401 167.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 62.2 mt -75.97 -11.5 59.97 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.526 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -169.36 13.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -108.3 -20.14 13.24 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 118.477 0.581 . . . . 0.0 112.341 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.428 ' O ' HG23 ' A' ' 62' ' ' VAL . 24.3 t70 -70.68 135.47 48.35 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 m -54.38 -35.84 63.26 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -172.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.45 -41.12 73.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.27 -35.89 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 123.866 0.729 . . . . 0.0 111.286 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 58' ' ' ASP . 62.4 t -64.06 -44.9 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.7 t -69.24 -37.82 78.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.922 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.93 -35.34 64.59 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.788 0.835 . . . . 0.0 110.796 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.15 -41.39 63.98 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.183 0.993 . . . . 0.0 109.527 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.3 t -60.23 -43.57 95.94 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.709 0.803 . . . . 0.0 109.835 173.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.72 -40.47 95.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.801 1.24 . . . . 0.0 110.639 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.513 ' HG2' HG13 ' A' ' 34' ' ' VAL . 6.7 tppt? -72.39 -56.58 5.22 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.246 -171.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.568 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 87.2 mt -57.99 -34.47 70.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.542 0.737 . . . . 0.0 111.261 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG3' ' HB ' ' A' ' 76' ' ' THR . 72.0 ttt180 -59.04 -34.9 72.46 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.07 1.348 . . . . 0.0 112.222 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -94.32 -58.39 2.23 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 122.953 0.501 . . . . 0.0 110.342 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -54.02 -44.43 70.94 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.663 1.185 . . . . 0.0 112.31 -176.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -118.75 -27.22 5.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.25 0.62 . . . . 0.0 112.162 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.8 7.08 64.91 Favored Glycine 0 N--CA 1.471 1.023 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.568 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 99.0 t -75.85 90.36 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.045 0 C-N-CA 124.153 0.981 . . . . 0.0 109.44 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.445 ' HB ' ' HG3' ' A' ' 70' ' ' ARG . 11.4 t -115.2 163.87 15.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.134 0.974 . . . . 0.0 111.069 -174.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 21.71 65.28 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.701 -0.682 . . . . 0.0 113.359 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 20.6 m -97.97 13.64 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.955 0.902 . . . . 0.0 111.646 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -48.85 -51.01 31.94 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.415 1.486 . . . . 0.0 112.373 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.51 -50.53 72.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.963 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.67 -30.34 71.31 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.29 -177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.6 mt -70.47 -36.18 73.73 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.257 0.623 . . . . 0.0 110.244 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -74.59 -23.96 58.82 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.135 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.79 -13.21 59.93 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.985 0.514 . . . . 0.0 111.752 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 80.3 mt -70.74 158.76 35.72 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.715 0.406 . . . . 0.0 110.734 176.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -136.57 -42.53 0.61 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.05 0.54 . . . . 0.0 110.103 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.422 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 74.9 p -115.71 159.44 21.39 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.315 0.646 . . . . 0.0 111.084 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.459 HG21 HG23 ' A' ' 46' ' ' ILE . 69.0 t -59.21 -36.69 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.137 177.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.405 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 8.0 m-20 -58.52 -35.71 72.7 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.458 176.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.422 ' HG2' ' OG1' ' A' ' 87' ' ' THR . 37.0 mm-40 -70.52 -37.3 74.09 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.251 0.621 . . . . 0.0 111.743 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.524 ' HG ' HD23 ' A' ' 31' ' ' LEU . 65.7 tp -61.88 -42.53 99.18 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 121.149 0.5 . . . . 0.0 110.607 173.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -63.06 -38.19 90.19 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.436 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 86.8 mm-40 -64.98 -48.27 74.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.913 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.4 tt -53.15 -61.06 2.54 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.532 1.133 . . . . 0.0 110.161 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.473 HG11 HD11 ' A' ' 31' ' ' LEU . 43.7 t -68.63 -31.62 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.236 -173.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.659 ' HG3' HH21 ' A' ' 99' ' ' ARG . 40.3 tt0 -61.05 -45.17 95.87 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.24 0.616 . . . . 0.0 111.086 174.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 74.1 mmtt -67.98 -46.26 71.85 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.869 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -70.06 -24.63 63.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.879 0.471 . . . . 0.0 111.551 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.659 HH21 ' HG3' ' A' ' 96' ' ' GLU . 18.5 ttp180 -66.84 -44.49 80.94 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.856 0.862 . . . . 0.0 109.853 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -89.54 -0.41 57.49 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.61 0.764 . . . . 0.0 111.94 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 65.27 75.0 0.37 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.297 1.439 . . . . 0.0 111.412 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.57 59.44 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 115.159 -0.928 . . . . 0.0 114.932 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.249 1.052 0 C-N-CA 123.254 0.622 . . . . 0.0 109.459 -174.623 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.01 165.44 37.72 Favored Glycine 0 C--N 1.345 1.042 0 N-CA-C 111.798 -0.521 . . . . 0.0 111.798 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.2 p -96.72 115.93 28.26 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.65 0.78 . . . . 0.0 110.184 -178.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.7 t -105.21 172.48 6.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.724 0.81 . . . . 0.0 110.338 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -154.48 161.18 41.81 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.835 0.854 . . . . 0.0 109.75 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -110.94 -172.69 2.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.716 0.806 . . . . 0.0 109.623 173.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -165.95 83.49 0.31 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.792 0.837 . . . . 0.0 109.249 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -63.38 126.88 28.9 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.23 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -141.8 124.4 15.88 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.661 0.784 . . . . 0.0 110.269 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -103.74 155.23 18.75 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.891 0.877 . . . . 0.0 109.182 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.0 p -155.8 34.08 0.35 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.016 0.927 . . . . 0.0 110.123 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.7 m -76.03 179.59 5.52 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.332 1.053 . . . . 0.0 112.121 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 86.84 16.93 60.57 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 123.14 0.4 . . . . 0.0 112.474 -178.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -81.58 125.12 30.15 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.034 0.934 . . . . 0.0 110.114 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -144.98 144.49 31.07 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.737 0.815 . . . . 0.0 110.069 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -155.47 88.8 1.16 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.787 0.835 . . . . 0.0 109.319 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.01 168.48 17.79 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.658 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.1 p90 -150.2 165.29 33.36 Favored 'General case' 0 C--O 1.246 0.902 0 C-N-CA 124.295 1.038 . . . . 0.0 109.946 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -156.29 15.06 0.32 Allowed 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.448 0.642 . . . . 0.0 110.369 173.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -79.08 86.29 4.92 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.874 -0.516 . . . . 0.0 110.066 -177.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.19 82.03 0.06 OUTLIER Glycine 0 C--N 1.34 0.793 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.756 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -159.01 133.56 7.96 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.47 0.708 . . . . 0.0 109.971 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.8 tpt -144.19 87.85 7.68 Favored Pre-proline 0 N--CA 1.478 0.962 0 C-N-CA 124.034 0.934 . . . . 0.0 109.109 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -77.72 86.6 1.62 Allowed 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.744 2.296 . . . . 0.0 111.027 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -136.5 88.75 2.4 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.124 0.569 . . . . 0.0 110.581 -175.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 25.9 t70 -171.41 157.16 4.8 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.616 1.166 . . . . 0.0 108.465 176.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.1 tpt -56.96 -63.44 1.21 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.607 1.163 . . . . 0.0 110.782 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.418 ' HA ' HD23 ' A' ' 31' ' ' LEU . 39.1 mt-10 -65.52 -32.67 74.39 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.141 0.976 . . . . 0.0 111.143 -175.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.409 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 6.8 t70 -54.03 -47.44 71.57 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 124.398 1.061 . . . . 0.0 110.793 172.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 34' ' ' VAL . 7.7 m-70 -72.77 -26.65 61.62 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.437 -175.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.429 HD11 HG21 ' A' ' 95' ' ' VAL . 3.5 mm? -60.79 -45.52 94.09 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.731 0.696 . . . . 0.0 109.314 168.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 5.9 mp -66.11 -36.31 82.83 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.478 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -68.25 -42.31 79.84 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.576 0.75 . . . . 0.0 110.682 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.545 HG13 ' HD2' ' A' ' 68' ' ' LYS . 61.3 t -61.13 -49.83 83.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.857 0.463 . . . . 0.0 110.505 178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 90.8 mt -66.74 -39.17 87.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.928 0.767 . . . . 0.0 112.291 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.9 p -65.52 -45.2 84.44 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.154 0.582 . . . . 0.0 111.59 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.0 t -71.13 -30.49 41.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 114.68 -1.145 . . . . 0.0 110.3 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.62 -37.24 62.87 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.061 0.544 . . . . 0.0 112.203 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.494 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 80.7 p -95.01 -60.95 1.57 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.183 0.593 . . . . 0.0 110.993 -173.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.5 -30.95 2.27 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.003 -177.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -72.12 141.3 83.68 Favored Pre-proline 0 C--N 1.356 0.854 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.899 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.552 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 19.3 Cg_endo -59.47 152.59 60.42 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.457 2.105 . . . . 0.0 112.307 176.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.471 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 13.7 ptmm? -60.78 -20.3 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.426 1.09 . . . . 0.0 112.316 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.63 -35.64 80.67 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.839 0.855 . . . . 0.0 111.32 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.552 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 20.3 mm-40 -75.94 -11.97 60.06 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.684 0.794 . . . . 0.0 111.942 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.447 ' HB ' ' HG ' ' A' ' 32' ' ' LEU . 23.7 mt -98.17 123.12 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 123.056 0.542 . . . . 0.0 110.478 -176.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.7 p -136.1 179.33 6.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.416 1.486 . . . . 0.0 107.692 172.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 89' ' ' ASP . 8.4 ptm180 -52.17 -56.36 15.06 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 123.558 0.743 . . . . 0.0 112.566 177.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -94.61 17.66 12.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.631 -0.668 . . . . 0.0 111.919 -175.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.0 t -70.55 -13.31 62.05 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.079 0.552 . . . . 0.0 111.165 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.448 ' HD3' HG23 ' A' ' 87' ' ' THR . 26.7 mmt180 71.51 177.06 0.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.145 1.378 . . . . 0.0 111.44 175.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.504 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 34.4 mtt -129.44 29.0 5.14 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.654 0.782 . . . . 0.0 111.401 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -56.78 -40.57 76.11 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.595 0.758 . . . . 0.0 110.659 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.03 -23.92 7.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.238 1.015 . . . . 0.0 110.597 174.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 5.0 mp -77.2 -30.17 54.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.682 0.793 . . . . 0.0 112.82 -166.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -166.03 89.18 0.4 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.4 0.68 . . . . 0.0 110.499 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -160.22 -33.65 0.06 Allowed 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.942 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -63.92 147.42 52.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.958 0.903 . . . . 0.0 111.424 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -55.76 -44.88 78.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.852 0.861 . . . . 0.0 112.422 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.3 tp -68.68 -39.28 80.63 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.732 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.519 HG13 ' HB1' ' A' ' 38' ' ' ALA . 81.0 t -65.8 -48.91 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 78.4 t -68.32 -38.82 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.753 0.821 . . . . 0.0 111.439 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 68.4 p -61.96 -55.66 27.13 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -61.65 -27.46 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.626 0.77 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 41.6 tp -64.26 -49.05 73.4 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.149 0.979 . . . . 0.0 109.852 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 85.2 p -68.24 -34.75 76.79 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.568 0.347 . . . . 0.0 111.26 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 63' ' ' SER . 85.1 mt -68.67 -33.09 73.39 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.703 0.801 . . . . 0.0 111.788 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' HG13 ' A' ' 34' ' ' VAL . 29.4 ttmt -85.5 -43.72 13.32 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.804 -175.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 94.3 mt -61.25 -27.9 68.78 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.534 0.734 . . . . 0.0 110.766 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -57.69 -40.2 78.91 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.575 1.15 . . . . 0.0 111.065 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -85.48 -45.77 11.5 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.19 0.596 . . . . 0.0 111.105 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.78 -51.96 35.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.129 0.972 . . . . 0.0 111.878 -170.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -123.51 -4.46 8.26 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.311 0.644 . . . . 0.0 112.176 -173.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.72 12.8 84.12 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-O 120.182 -0.232 . . . . 0.0 113.288 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.476 HG12 HG21 ' A' ' 78' ' ' VAL . 57.3 t -86.79 107.13 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.861 0.865 . . . . 0.0 109.406 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 m -136.89 156.33 48.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.447 1.099 . . . . 0.0 109.597 -171.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.04 35.25 90.36 Favored Glycine 0 C--N 1.354 1.549 0 O-C-N 123.672 0.607 . . . . 0.0 111.996 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 75' ' ' VAL . 20.5 m -119.62 4.21 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.387 1.075 . . . . 0.0 110.704 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 82' ' ' LEU . 7.1 p-10 -55.83 -37.94 69.38 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.496 1.119 . . . . 0.0 112.656 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.55 -50.93 71.99 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.789 0.681 . . . . 0.0 110.744 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.76 -23.52 64.33 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.921 -178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 79' ' ' ASP . 87.7 mt -73.27 -31.26 63.96 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.551 0.741 . . . . 0.0 111.19 175.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.21 -37.37 85.39 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.522 0.514 . . . . 0.0 109.774 171.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.99 -0.26 30.39 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.014 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 94' ' ' LEU . 79.6 mt -82.17 144.24 30.87 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 169.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.36 -8.44 2.56 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.992 0.917 . . . . 0.0 110.38 174.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.448 HG23 ' HD3' ' A' ' 51' ' ' ARG . 4.2 m -138.96 147.1 41.79 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.97 -31.91 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.676 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 38.2 t70 -56.79 -40.62 76.23 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.816 0.846 . . . . 0.0 110.059 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.71 -29.57 64.7 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.979 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.479 ' HB2' ' HE3' ' A' ' 52' ' ' MET . 67.1 tp -64.19 -45.52 87.98 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.218 0.607 . . . . 0.0 111.162 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -58.64 -45.55 89.06 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.682 0.614 . . . . 0.0 109.653 177.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 19.0 mm100 -61.78 -38.59 88.64 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.293 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -62.68 -61.79 2.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.042 0.937 . . . . 0.0 110.207 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.456 HG13 HG21 ' A' ' 75' ' ' VAL . 92.5 t -60.6 -44.53 97.02 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.129 -172.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -66.45 -35.62 80.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -67.36 -38.06 84.19 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.693 0.224 . . . . 0.0 111.475 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -84.34 -17.67 38.71 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.008 0.523 . . . . 0.0 111.981 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -82.3 -48.46 11.17 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.52 37.29 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.61 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 62.84 -167.7 0.21 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.685 1.194 . . . . 0.0 111.09 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -178.41 56.05 0.09 OUTLIER Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.254 1.32 0 C-N-CA 123.447 0.699 . . . . 0.0 109.384 -179.687 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptt? . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.7 34.78 0.03 OUTLIER Glycine 0 C--N 1.345 1.043 0 CA-C-N 116.213 -0.448 . . . . 0.0 113.128 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 66.2 p -76.14 123.75 26.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.26 0.624 . . . . 0.0 109.901 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.2 p -148.91 112.02 4.91 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.258 0.623 . . . . 0.0 109.694 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -132.24 140.05 48.51 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.318 1.047 . . . . 0.0 109.374 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -85.02 -176.7 6.31 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.58 0.752 . . . . 0.0 111.282 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 -152.23 133.86 14.66 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 172.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 p-80 -144.17 120.55 10.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.014 0.526 . . . . 0.0 110.072 177.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -144.76 148.07 33.67 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.282 1.033 . . . . 0.0 108.838 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 p80 -134.48 105.57 6.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.28 0.632 . . . . 0.0 109.396 178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.6 p -80.19 77.66 6.9 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 173.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.8 p -105.45 133.6 49.94 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 124.462 1.105 . . . . 0.0 109.898 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -147.5 165.47 28.72 Favored Glycine 0 C--N 1.34 0.802 0 O-C-N 123.099 0.249 . . . . 0.0 112.804 -177.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -124.7 168.92 12.52 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.236 1.014 . . . . 0.0 109.051 174.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.87 127.44 32.63 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.248 0.619 . . . . 0.0 110.062 175.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -71.4 -62.83 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.044 0.538 . . . . 0.0 110.528 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 mp -105.96 159.48 16.01 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.202 1.001 . . . . 0.0 109.884 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -135.47 174.76 10.25 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.862 1.265 . . . . 0.0 108.458 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -110.29 117.93 34.97 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -80.22 111.47 16.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.23 0.612 . . . . 0.0 109.611 -177.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.45 166.68 40.42 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.973 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -78.74 -68.94 0.6 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.309 1.044 . . . . 0.0 110.067 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 87.8 mtp -141.66 102.78 5.9 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.028 0.931 . . . . 0.0 108.728 177.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -80.22 56.69 6.17 Favored 'Trans proline' 0 C--N 1.372 1.772 0 C-N-CA 123.171 2.58 . . . . 0.0 112.623 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -61.18 -61.85 2.27 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.058 0.943 . . . . 0.0 109.509 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -155.42 -78.68 0.09 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.313 169.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.6 ptm -54.77 -35.36 63.71 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -166.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.2 -56.13 16.87 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.36 -35.53 80.59 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.034 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -70.5 -51.66 27.39 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.955 0.902 . . . . 0.0 110.742 -169.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HA ' HG12 ' A' ' 34' ' ' VAL . 4.1 mm? -66.95 -33.76 76.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.331 0.395 . . . . 0.0 110.154 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.5 -32.79 74.58 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 110.588 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' HG23 ' A' ' 37' ' ' VAL . 97.8 m -71.93 -51.32 22.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.427 0.691 . . . . 0.0 111.018 178.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' A' ' 31' ' ' LEU . 13.3 p -62.46 -31.65 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 122.208 0.203 . . . . 0.0 110.819 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.539 HD11 HD23 ' A' ' 91' ' ' LEU . 87.1 mt -73.16 -34.2 65.9 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.252 0.621 . . . . 0.0 111.439 173.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.6 t -64.64 -36.6 84.77 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.371 0.668 . . . . 0.0 111.12 177.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 33' ' ' THR . 22.0 t -82.77 -25.29 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.517 0.727 . . . . 0.0 110.224 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.56 -43.71 54.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.45 0.7 . . . . 0.0 111.453 178.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.8 p -86.94 -50.39 6.71 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.758 0.823 . . . . 0.0 110.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 122.78 -33.04 4.23 Favored Glycine 0 C--N 1.341 0.817 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.007 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.1 m -73.43 130.17 84.54 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 123.006 0.522 . . . . 0.0 111.124 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -54.77 157.53 12.52 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.397 2.731 . . . . 0.0 114.151 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -56.85 -27.4 60.24 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.358 1.063 . . . . 0.0 112.463 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -68.17 -21.37 64.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.757 0.823 . . . . 0.0 111.801 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -105.33 2.98 29.36 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.541 0.737 . . . . 0.0 111.545 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -113.04 120.91 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.293 0.637 . . . . 0.0 109.307 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.6 m -100.85 167.31 10.36 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.318 0.647 . . . . 0.0 109.302 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -71.29 -19.41 62.34 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.836 0.35 . . . . 0.0 110.757 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -123.23 79.23 1.65 Allowed 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.4 m -125.08 20.27 8.26 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.549 1.14 . . . . 0.0 108.929 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 56.08 -169.84 0.09 Allowed 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 112.312 -170.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 49.8 ttm -147.24 84.8 1.58 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.577 0.703 . . . . 0.0 109.254 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.36 -4.13 8.37 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.608 174.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -137.18 -36.41 0.66 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.333 0.653 . . . . 0.0 110.63 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 69.6 mt -66.64 -36.85 83.56 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -167.65 79.81 0.18 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.526 0.73 . . . . 0.0 110.142 177.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -147.76 -15.79 0.37 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.468 0.307 . . . . 0.0 111.327 -175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -91.7 150.22 21.24 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.719 0.808 . . . . 0.0 109.338 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -54.04 -45.86 71.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.92 0.888 . . . . 0.0 112.616 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.05 -36.1 74.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.716 0.407 . . . . 0.0 110.551 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.509 HG13 ' HB1' ' A' ' 38' ' ' ALA . 38.4 t -71.3 -40.35 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.214 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 51.3 t -69.81 -39.8 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.915 0.886 . . . . 0.0 110.291 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.488 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 41.5 t -64.37 -46.31 83.92 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.634 0.584 . . . . 0.0 110.264 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -62.19 -43.43 98.86 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.975 0.797 . . . . 0.0 110.563 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.57 -49.34 72.98 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.929 173.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.9 t -65.64 -22.79 66.69 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.159 0.984 . . . . 0.0 112.081 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 63' ' ' SER . 91.1 mt -67.61 -52.12 42.21 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -26.12 61.26 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.36 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.598 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 30.8 mt -67.79 -46.26 72.5 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 174.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -63.28 -42.24 99.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.023 0.929 . . . . 0.0 110.515 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -69.64 -46.4 66.25 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.51 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.33 -49.53 4.22 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.82 -168.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -97.75 -11.64 23.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.377 0.671 . . . . 0.0 111.982 -174.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.02 8.66 86.92 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 123.328 0.392 . . . . 0.0 113.968 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 46.2 t -86.46 108.21 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.35 0.66 . . . . 0.0 110.529 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.0 t -150.31 167.24 27.6 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.99 0.916 . . . . 0.0 109.756 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 24.32 75.14 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 112.046 -0.422 . . . . 0.0 112.046 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 31.6 m -126.09 18.19 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.431 1.092 . . . . 0.0 110.965 -172.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -51.85 -40.92 61.36 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.586 1.154 . . . . 0.0 113.2 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -70.1 -39.41 75.53 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.009 0.924 . . . . 0.0 110.681 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.26 -33.08 71.18 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.394 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.94 -29.84 62.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.715 0.806 . . . . 0.0 111.094 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -73.05 -32.54 65.12 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.969 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.41 -17.86 61.77 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.637 0.775 . . . . 0.0 110.632 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.04 132.96 55.05 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.218 0.607 . . . . 0.0 111.849 177.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.26 -6.55 5.37 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.985 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.6 p -139.94 154.35 47.19 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.412 0.625 . . . . 0.0 111.398 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.4 t -68.58 -40.81 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.771 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.479 ' HA ' ' HD2' ' A' ' 92' ' ' PHE . 9.4 t70 -64.94 -30.21 71.19 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.755 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.26 -41.38 81.16 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.259 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.539 HD23 HD11 ' A' ' 35' ' ' LEU . 59.6 tp -62.63 -42.08 99.39 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 123.464 0.477 . . . . 0.0 111.036 175.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.479 ' HD2' ' HA ' ' A' ' 89' ' ' ASP . 27.0 m-85 -54.57 -48.77 71.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.868 0.467 . . . . 0.0 110.525 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 79.7 mt-30 -68.96 -37.79 79.03 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.555 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.8 tt -57.46 -55.88 29.04 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.904 0.882 . . . . 0.0 110.2 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.9 t -61.26 -42.55 93.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.491 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -56.67 -42.44 79.01 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.266 0.979 . . . . 0.0 110.771 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 33.4 mmtp -66.64 -47.29 73.04 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.687 0.395 . . . . 0.0 111.737 -178.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -74.96 -18.43 60.39 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.976 0.51 . . . . 0.0 112.043 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -82.64 -55.41 4.47 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.539 0.736 . . . . 0.0 109.955 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.31 -26.69 62.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.751 0.82 . . . . 0.0 111.594 -176.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -106.23 92.78 4.28 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.81 74.19 1.17 Allowed Glycine 0 C--N 1.348 1.238 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.556 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.1 p . . . . . 0 C--O 1.253 1.253 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -173.331 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.13 79.73 1.58 Allowed Glycine 0 C--N 1.353 1.484 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -133.37 24.49 4.12 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.689 0.796 . . . . 0.0 110.642 -172.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.1 p -88.46 105.48 17.64 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.121 0.569 . . . . 0.0 110.784 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.4 m170 -79.46 123.13 27.26 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -99.12 149.31 23.18 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -108.7 61.19 0.6 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.949 0.9 . . . . 0.0 109.863 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -68.34 96.73 0.68 Allowed 'General case' 0 C--N 1.352 0.705 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -101.96 125.81 48.72 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.909 0.883 . . . . 0.0 110.384 -176.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -159.97 -33.13 0.06 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.494 1.118 . . . . 0.0 109.291 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.0 m -65.99 114.5 5.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.504 0.722 . . . . 0.0 109.673 172.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -132.08 147.89 52.46 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.481 0.712 . . . . 0.0 110.323 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.62 121.55 22.5 Favored Glycine 0 C--N 1.344 1.001 0 O-C-N 124.271 0.982 . . . . 0.0 112.632 -175.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -84.22 -68.15 0.74 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.681 0.792 . . . . 0.0 109.101 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 52.27 26.89 4.29 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 125.443 1.497 . . . . 0.0 111.445 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -81.48 102.42 10.55 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.163 0.985 . . . . 0.0 109.526 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp 58.77 36.78 24.99 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.242 1.017 . . . . 0.0 111.025 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -87.2 76.69 9.18 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.355 -176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -102.93 103.77 13.93 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.756 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -84.04 -62.92 1.45 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 61.09 -90.68 0.05 OUTLIER Glycine 0 C--N 1.352 1.431 0 O-C-N 124.441 1.088 . . . . 0.0 112.981 177.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -99.77 23.86 9.11 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.212 1.005 . . . . 0.0 111.169 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 tpt -125.97 72.48 70.04 Favored Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 170.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -98.58 -156.84 0.04 OUTLIER 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.557 2.838 . . . . 0.0 112.15 177.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 69.82 -82.73 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.129 1.372 . . . . 0.0 110.389 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.8 t70 9.39 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 128.144 2.578 . . . . 0.0 114.874 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 23.1 ptm -130.31 -45.15 1.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.593 0.757 . . . . 0.0 110.341 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.46 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 42.9 mt-10 -59.05 -57.15 14.35 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.491 0.716 . . . . 0.0 112.767 -167.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.68 -25.29 67.88 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.984 0.803 . . . . 0.0 111.816 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.1 m80 -67.93 -45.41 74.4 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.64 0.587 . . . . 0.0 110.287 171.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 7.4 mp -67.26 -28.93 68.44 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.544 0.337 . . . . 0.0 111.495 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.536 ' HA ' HG21 ' A' ' 46' ' ' ILE . 8.4 mp -63.24 -38.7 92.18 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.696 0.399 . . . . 0.0 109.991 172.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -73.99 -34.11 64.07 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.086 0.866 . . . . 0.0 110.656 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.4 t -63.06 -58.06 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.141 0.576 . . . . 0.0 110.2 178.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.42 -40.77 97.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.548 0.739 . . . . 0.0 111.455 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.9 p -63.2 -56.9 12.8 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.467 0.479 . . . . 0.0 111.32 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.1 t -67.44 -41.38 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 C-N-CA 123.336 0.654 . . . . 0.0 111.271 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.69 -28.2 68.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.208 0.603 . . . . 0.0 112.145 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.9 m -92.9 -25.63 17.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.968 0.507 . . . . 0.0 111.394 177.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.88 17.15 58.53 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 123.001 0.334 . . . . 0.0 112.915 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.4 m -102.11 160.76 25.46 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 124.617 1.167 . . . . 0.0 109.945 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -70.23 158.67 55.62 Favored 'Trans proline' 0 C--N 1.368 1.595 0 C-N-CA 122.323 2.015 . . . . 0.0 112.692 168.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -64.76 -20.01 66.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.81 0.844 . . . . 0.0 111.182 173.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.94 -31.52 65.05 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.286 1.034 . . . . 0.0 110.97 173.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -96.4 15.84 20.2 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.99 0.916 . . . . 0.0 111.104 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.536 HG21 ' HA ' ' A' ' 32' ' ' LEU . 21.1 mm -123.46 141.11 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.69 0.796 . . . . 0.0 109.621 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 p -155.43 -168.6 2.88 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.173 0.989 . . . . 0.0 109.706 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.465 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 62.0 mtp85 -75.18 -9.09 58.23 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 176.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -162.71 92.93 0.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 161.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.7 t -106.27 14.13 27.89 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.191 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.685 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 44.8 mmt-85 60.84 104.5 0.02 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 124.37 1.068 . . . . 0.0 111.757 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.49 ' SD ' HD22 ' A' ' 91' ' ' LEU . 71.4 mtm -74.38 -2.16 24.13 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.936 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.685 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 12.7 pt-20 -61.06 -31.41 71.06 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.144 0.578 . . . . 0.0 110.908 173.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -87.51 -39.53 15.09 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.766 0.826 . . . . 0.0 109.986 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.9 mt -81.87 -86.49 0.1 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.724 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -104.44 80.37 1.68 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.497 0.719 . . . . 0.0 110.199 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -145.0 -11.05 0.57 Allowed 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.809 -177.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.45 148.02 26.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -53.8 -40.23 66.16 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.164 0.985 . . . . 0.0 112.638 -174.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -74.39 -39.03 62.94 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.09 0.556 . . . . 0.0 110.708 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 22.7 t -70.9 -37.23 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 116.795 -0.184 . . . . 0.0 110.983 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.4 t -68.62 -34.03 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 123.583 0.753 . . . . 0.0 110.011 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.1 t -67.22 -42.15 84.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.876 0.47 . . . . 0.0 110.73 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.86 -23.09 52.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.084 0.954 . . . . 0.0 111.643 177.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.13 -50.28 42.16 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 173.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.5 t -60.96 -41.96 97.35 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.48 1.112 . . . . 0.0 110.772 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.0 tp -57.93 -48.87 78.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.539 1.136 . . . . 0.0 110.715 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -68.33 -40.85 81.48 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.141 0.976 . . . . 0.0 111.073 -175.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.42 ' HA ' ' HD1' ' A' ' 73' ' ' PHE . 90.1 mt -65.13 -41.57 94.71 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.499 0.72 . . . . 0.0 110.591 179.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -70.59 -34.69 72.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.67 0.788 . . . . 0.0 111.121 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -77.78 -62.74 1.57 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.963 0.505 . . . . 0.0 111.461 -172.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.15 -50.89 17.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.911 0.485 . . . . 0.0 111.836 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' A' ' 69' ' ' LEU . 32.8 m-85 -91.92 -31.02 15.81 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.256 0.623 . . . . 0.0 111.689 -168.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.79 5.79 80.78 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.741 -173.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.632 HG21 HG13 ' A' ' 95' ' ' VAL . 88.3 t -77.11 87.68 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 122.106 0.955 . . . . 0.0 109.638 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.0 m -101.68 162.06 13.19 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 114.063 -1.426 . . . . 0.0 109.928 -177.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.84 38.85 93.26 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 123.503 0.502 . . . . 0.0 113.094 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.481 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 17.4 m -113.89 5.16 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.971 0.909 . . . . 0.0 111.443 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.59 -46.18 84.33 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.855 1.262 . . . . 0.0 112.723 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.48 -37.74 87.72 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.483 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.551 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 7.6 mp0 -66.69 -40.46 88.54 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.615 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 85.3 mt -59.98 -37.13 78.72 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.568 0.747 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.53 -38.63 87.57 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.059 174.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.03 -20.7 59.47 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.26 0.624 . . . . 0.0 111.719 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 95.5 mt -84.09 154.02 23.43 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.443 0.697 . . . . 0.0 112.066 -176.492 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.521 ' HG3' HG23 ' A' ' 87' ' ' THR . 9.3 pt-20 -136.48 -37.61 0.69 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 109.196 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HG3' ' A' ' 86' ' ' GLU . 11.9 p -102.56 143.28 32.46 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 125.675 1.59 . . . . 0.0 110.538 -173.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.3 t -77.81 -25.81 14.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.173 -173.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -64.81 -39.88 94.3 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.569 0.699 . . . . 0.0 109.854 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.489 ' HB3' HD22 ' A' ' 85' ' ' LEU . 3.9 mp0 -65.47 -36.27 83.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.921 173.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.49 HD22 ' SD ' ' A' ' 52' ' ' MET . 63.7 tp -66.4 -35.25 79.86 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.998 0.519 . . . . 0.0 111.397 172.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.465 ' HE2' ' HA ' ' A' ' 48' ' ' ARG . 21.5 m-85 -66.16 -51.73 55.05 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.285 0.634 . . . . 0.0 110.506 178.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.443 ' O ' ' HB2' ' A' ' 97' ' ' LYS . 4.3 pt20 -70.08 -18.51 63.26 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.566 0.347 . . . . 0.0 111.513 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 85' ' ' LEU . 64.9 tp -68.99 -47.7 64.92 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.962 0.505 . . . . 0.0 110.614 171.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.632 HG13 HG21 ' A' ' 75' ' ' VAL . 75.9 t -64.56 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.53 0.732 . . . . 0.0 110.229 176.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 93' ' ' GLN . 33.1 tt0 -60.94 -40.8 94.68 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.543 1.137 . . . . 0.0 110.688 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 6.6 tmtt? -63.58 -44.04 95.2 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.301 1.04 . . . . 0.0 109.71 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.8 -24.28 52.81 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.45 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -86.98 -39.05 16.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 123.339 0.399 . . . . 0.0 110.985 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.69 -56.64 4.26 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.461 0.704 . . . . 0.0 109.917 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.11 113.16 22.62 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.82 99.12 0.07 OUTLIER Glycine 0 C--N 1.353 1.496 0 O-C-N 124.441 1.088 . . . . 0.0 113.963 -171.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 C--O 1.245 0.843 0 C-N-CA 123.67 0.788 . . . . 0.0 109.08 178.097 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.6 ttm . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -91.17 -148.86 22.43 Favored Glycine 0 C--N 1.342 0.914 0 N-CA-C 112.332 -0.307 . . . . 0.0 112.332 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 m -148.92 118.88 7.13 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 109.168 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.3 t -143.49 99.52 3.44 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.153 0.581 . . . . 0.0 109.965 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -157.9 150.96 23.03 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 171.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -78.42 139.46 38.74 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -85.27 -19.27 31.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.231 0.612 . . . . 0.0 111.432 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 22.7 t-80 -91.32 11.23 24.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.199 0.599 . . . . 0.0 111.818 -173.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -63.33 102.41 0.4 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.968 0.507 . . . . 0.0 110.121 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -121.89 142.98 49.72 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.979 0.912 . . . . 0.0 110.176 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.7 t -100.38 162.78 12.72 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 123.399 0.68 . . . . 0.0 109.846 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.3 p -81.98 108.84 15.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.269 0.628 . . . . 0.0 109.469 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -134.5 -75.21 0.09 OUTLIER Glycine 0 C--N 1.344 1.0 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 52.21 89.12 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.035 1.334 . . . . 0.0 112.158 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.63 145.91 55.48 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.8 0.84 . . . . 0.0 110.681 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -60.0 -33.24 71.71 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 123.941 0.776 . . . . 0.0 110.767 -174.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 tt -123.35 99.66 6.45 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 174.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -119.03 21.79 12.2 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.448 0.699 . . . . 0.0 110.719 -175.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -61.43 -31.79 71.74 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.78 0.832 . . . . 0.0 111.976 -171.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -70.87 143.14 51.13 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.776 0.831 . . . . 0.0 110.265 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.29 -30.3 6.82 Favored Glycine 0 C--N 1.342 0.878 0 N-CA-C 112.11 -0.396 . . . . 0.0 112.11 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -75.41 112.67 11.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.878 0.471 . . . . 0.0 110.155 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -103.0 142.3 24.28 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 168.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -78.03 -4.25 14.22 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.813 2.342 . . . . 0.0 112.214 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 -73.55 89.97 1.73 Allowed 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.053 0.941 . . . . 0.0 109.414 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 29' ' ' ASP . 22.8 t70 -168.66 170.96 9.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.154 0.982 . . . . 0.0 108.776 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.1 tpt -84.11 -62.22 1.62 Allowed 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 174.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 44.4 mt-10 -62.71 -56.84 14.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.697 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 26' ' ' ASP . 25.3 t70 -58.82 -37.24 75.96 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 124.518 1.136 . . . . 0.0 111.752 -173.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -67.94 -45.45 74.25 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.275 0.63 . . . . 0.0 111.141 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -70.14 -28.62 65.51 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 35' ' ' LEU . 9.4 tp -73.82 -27.04 60.91 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.269 1.028 . . . . 0.0 109.903 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 m -70.32 -42.38 72.0 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.741 0.816 . . . . 0.0 109.606 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.54 -42.95 77.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.313 0.645 . . . . 0.0 110.525 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 32' ' ' LEU . 90.1 mt -67.58 -39.67 84.84 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.11 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 76.4 p -71.6 -29.33 64.57 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.843 0.457 . . . . 0.0 111.191 -176.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -75.15 -40.07 43.77 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 C-N-CA 123.063 0.545 . . . . 0.0 110.312 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.44 -35.55 75.78 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.747 0.819 . . . . 0.0 112.023 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 78.1 p -91.81 -55.6 3.41 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.267 0.627 . . . . 0.0 110.766 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.61 -26.85 5.88 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.072 -175.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.67 148.75 66.34 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.347 0.659 . . . . 0.0 110.408 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.475 ' HD2' ' HG3' ' A' ' 45' ' ' GLU . 76.7 Cg_exo -53.55 159.21 6.73 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 123.396 2.731 . . . . 0.0 113.99 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 8.8 mtmp? -60.42 -36.42 78.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.986 0.914 . . . . 0.0 110.692 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.02 -8.75 57.97 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.057 0.943 . . . . 0.0 112.046 -177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.475 ' HG3' ' HD2' ' A' ' 42' ' ' PRO . 34.6 mm-40 -90.89 -3.79 57.06 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.647 0.779 . . . . 0.0 110.743 170.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.4 mt -115.45 138.71 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.157 0.983 . . . . 0.0 109.323 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -133.77 161.98 33.23 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.007 0.923 . . . . 0.0 108.667 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.71 -34.6 78.21 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.8 -20.16 60.97 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.926 1.291 . . . . 0.0 112.445 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -74.05 155.99 37.95 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.263 1.025 . . . . 0.0 111.429 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -91.87 176.47 6.51 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.622 0.769 . . . . 0.0 110.326 173.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 55.3 mtt -110.58 111.97 23.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.687 0.795 . . . . 0.0 110.639 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -135.51 -53.33 0.77 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 174.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.95 -38.07 9.14 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.072 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 39' ' ' SER . 56.5 mt -66.28 -43.14 87.21 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.552 -170.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.55 84.95 0.17 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.976 0.798 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -152.56 -48.23 0.1 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.319 0.248 . . . . 0.0 110.54 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 61' ' ' VAL . 18.3 t70 -62.92 144.14 57.03 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.56 0.538 . . . . 0.0 110.048 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.7 p -55.7 -44.74 77.67 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 111.702 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.88 -40.03 94.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.688 0.795 . . . . 0.0 111.087 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 58' ' ' ASP . 93.1 t -62.81 -43.5 98.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.03 0.532 . . . . 0.0 110.724 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.67 -30.83 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.031 0.933 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.0 m -66.46 -42.73 87.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.479 0.712 . . . . 0.0 110.108 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.41 -32.56 64.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.163 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.92 -46.18 82.74 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 0.0 110.317 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.0 p -70.61 -30.45 67.11 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.689 0.796 . . . . 0.0 111.028 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.54 -39.11 85.01 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.713 0.805 . . . . 0.0 109.619 173.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 5.9 mptp? -66.49 -44.12 83.53 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 123.521 0.728 . . . . 0.0 109.515 174.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.3 mt -64.0 -27.03 68.84 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.357 0.411 . . . . 0.0 111.259 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -49.49 77.62 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.434 0.693 . . . . 0.0 110.147 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -72.21 -43.39 64.53 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.377 -175.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 15.1 mm-40 -82.61 -52.32 6.92 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.693 0.797 . . . . 0.0 111.102 -168.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -126.31 0.57 7.04 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -171.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 70.47 6.47 58.39 Favored Glycine 0 N--CA 1.478 1.489 0 CA-C-O 119.777 -0.457 . . . . 0.0 114.031 -177.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 90.6 t -80.4 124.2 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.161 0.984 . . . . 0.0 110.674 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.2 m -149.0 155.72 41.21 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.715 0.806 . . . . 0.0 109.798 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.43 -18.2 57.47 Favored Glycine 0 C--N 1.348 1.223 0 CA-C-N 116.421 -0.354 . . . . 0.0 112.518 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.1 m -79.84 8.42 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 124.543 1.137 . . . . 0.0 112.144 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.35 -40.39 61.9 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.745 1.218 . . . . 0.0 112.145 -176.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.04 -46.3 81.87 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.978 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -68.66 -28.58 67.01 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.042 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.59 -37.8 77.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.103 0.961 . . . . 0.0 109.806 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.44 -32.25 73.79 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.255 174.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -79.18 -16.45 56.58 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.1 mt -70.75 138.45 50.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.586 0.354 . . . . 0.0 110.205 175.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -125.79 -11.53 6.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.531 0.732 . . . . 0.0 109.581 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.408 ' HB ' ' HG3' ' A' ' 90' ' ' GLU . 2.0 m -135.9 146.91 47.88 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 123.081 0.552 . . . . 0.0 109.979 -175.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.39 -30.32 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.267 -174.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -52.5 -49.12 65.39 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 123.48 0.488 . . . . 0.0 110.459 170.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HB ' ' A' ' 87' ' ' THR . 47.4 mt-10 -61.16 -40.15 92.78 Favored 'General case' 0 C--N 1.35 0.6 0 O-C-N 124.499 1.124 . . . . 0.0 110.877 -176.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.73 -48.66 78.25 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.707 0.63 . . . . 0.0 111.785 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.435 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 9.3 m-85 -58.18 -39.1 78.04 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.485 0.49 . . . . 0.0 110.693 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -77.31 -31.83 54.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.662 0.601 . . . . 0.0 111.46 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.31 -55.38 8.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.18 0.592 . . . . 0.0 109.925 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.3 -43.92 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.482 1.113 . . . . 0.0 110.634 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -63.54 -40.93 98.29 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.973 0.796 . . . . 0.0 111.289 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.85 -29.39 66.62 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.201 0.6 . . . . 0.0 111.083 -177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -78.4 -36.97 45.07 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.626 0.77 . . . . 0.0 110.959 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.88 -37.42 55.55 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.512 1.125 . . . . 0.0 110.868 -176.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.76 -46.35 11.49 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.551 0.74 . . . . 0.0 109.902 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 58.83 -164.13 0.21 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 124.754 1.222 . . . . 0.0 112.305 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 122.88 -67.44 0.48 Allowed Glycine 0 C--N 1.348 1.222 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.25 1.102 0 C-N-CA 123.834 0.854 . . . . 0.0 109.336 -179.854 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 129.91 160.5 10.14 Favored Glycine 0 C--N 1.349 1.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.308 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.1 t -163.13 139.65 7.24 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.51 0.724 . . . . 0.0 109.726 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p -79.29 -11.6 59.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.787 0.835 . . . . 0.0 111.262 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 71.32 -176.92 0.2 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.643 1.577 . . . . 0.0 112.009 177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -71.09 155.05 41.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.095 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -141.64 87.32 2.05 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -70.23 119.15 13.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.151 -174.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -121.54 140.89 51.64 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.113 0.965 . . . . 0.0 109.204 176.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -80.73 108.35 14.31 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 25.6 m -87.4 29.32 0.87 Allowed 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.147 0.979 . . . . 0.0 110.924 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 p -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.73 1.212 . . . . 0.0 112.01 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.4 -133.62 0.64 Allowed Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.504 -0.609 . . . . 0.0 111.933 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 59.07 70.72 0.63 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.248 1.019 . . . . 0.0 110.393 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -107.48 12.99 27.31 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.771 1.228 . . . . 0.0 110.454 -177.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -84.0 30.47 0.52 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.78 1.232 . . . . 0.0 112.525 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.9 tp 73.5 145.41 0.08 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.27 1.428 . . . . 0.0 111.352 -179.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -74.44 131.46 41.08 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.764 0.826 . . . . 0.0 110.664 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -63.04 109.12 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.472 0.709 . . . . 0.0 110.618 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.431 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 1.6 pp0? -128.93 119.79 24.99 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.7 0.8 . . . . 0.0 109.589 176.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.12 59.52 0.84 Allowed Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.965 -1.254 . . . . 0.0 109.965 171.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 65.28 -73.6 0.06 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.4 1.48 . . . . 0.0 109.529 -169.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 mtm -113.46 95.65 36.92 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 168.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.431 ' HB3' ' HA ' ' A' ' 20' ' ' GLN . 70.4 Cg_endo -79.75 53.27 4.66 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 123.414 2.743 . . . . 0.0 113.4 -175.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -146.36 138.61 25.08 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.749 0.819 . . . . 0.0 109.121 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.411 ' H ' ' HB3' ' A' ' 29' ' ' ASP . 33.2 t70 -167.5 169.65 11.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -176.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.6 -46.9 80.6 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.18 0.592 . . . . 0.0 110.826 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -61.74 -40.03 93.65 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.29 0.994 . . . . 0.0 110.918 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 26' ' ' ASP . 31.9 t70 -64.4 -43.09 95.49 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.6 m-70 -69.03 -37.06 78.41 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.638 0.775 . . . . 0.0 110.801 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.2 tp -71.25 -39.39 71.64 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.289 0.636 . . . . 0.0 111.071 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 9.2 mp -69.0 -32.48 72.06 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.843 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.7 m -70.58 -34.35 72.09 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.696 0.399 . . . . 0.0 110.713 173.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 68' ' ' LYS . 20.4 t -56.83 -46.87 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.361 0.664 . . . . 0.0 109.772 172.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -68.3 -36.68 79.71 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.962 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.3 p -68.33 -36.16 78.86 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.826 0.45 . . . . 0.0 111.751 -176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.3 -27.63 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.261 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.37 -41.72 63.06 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.162 0.585 . . . . 0.0 111.341 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.3 p -91.2 -63.07 1.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.468 0.707 . . . . 0.0 111.137 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.55 -38.58 1.56 Allowed Glycine 0 C--N 1.343 0.971 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -68.37 141.91 94.01 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.347 0.659 . . . . 0.0 110.368 175.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.441 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 56.6 Cg_endo -67.08 158.16 58.19 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.795 2.33 . . . . 0.0 111.639 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.745 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 20.5 pttm -68.15 -18.41 64.61 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.24 -31.11 65.2 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 124.226 1.011 . . . . 0.0 111.668 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 15.7 mm-40 -85.57 -23.98 27.41 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.865 0.866 . . . . 0.0 111.502 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -87.16 142.45 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 123.586 0.754 . . . . 0.0 111.051 -172.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.0 t -150.15 177.94 9.44 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.522 1.129 . . . . 0.0 109.195 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.7 mtt-85 -69.86 -24.7 63.47 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.87 0.468 . . . . 0.0 110.599 172.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -65.8 -32.39 73.9 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.102 0.876 . . . . 0.0 110.814 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.8 m -60.34 106.64 0.55 Allowed 'General case' 0 C--N 1.357 0.917 0 O-C-N 124.337 1.023 . . . . 0.0 110.551 -177.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.4 mtt-85 -81.4 155.48 25.88 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 169.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.8 mmt -69.68 90.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.789 0.68 . . . . 0.0 109.823 -176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -103.11 -18.09 15.1 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.276 1.03 . . . . 0.0 110.404 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -155.35 -47.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.949 1.3 . . . . 0.0 107.703 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.522 ' H ' HD12 ' A' ' 55' ' ' LEU . 1.6 mp -59.23 122.68 14.45 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.588 172.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.648 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . 53.75 21.88 2.9 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.098 0.959 . . . . 0.0 113.557 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -115.78 19.49 15.16 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 121.774 0.797 . . . . 0.0 111.41 -172.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 61' ' ' VAL . 24.3 t70 -147.79 149.12 31.76 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 172.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.3 p -50.0 -42.65 49.53 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.972 1.309 . . . . 0.0 113.147 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.3 -38.19 74.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 110.87 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.45 HG12 ' H ' ' A' ' 56' ' ' ALA . 25.2 t -76.15 -28.49 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.424 0.69 . . . . 0.0 111.304 -176.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.525 HG13 ' HB2' ' A' ' 82' ' ' LEU . 60.1 t -73.07 -43.26 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 124.096 0.959 . . . . 0.0 109.456 175.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.4 t -60.96 -43.06 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.838 0.711 . . . . 0.0 110.053 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 9.9 tp10 -65.65 -38.32 89.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.377 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.648 HD22 ' HB2' ' A' ' 56' ' ' ALA . 45.2 tp -64.23 -45.51 87.89 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 124.143 0.902 . . . . 0.0 110.521 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.6 t -65.44 -44.53 86.98 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.627 0.771 . . . . 0.0 111.292 -177.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.6 mt -67.53 -30.89 70.66 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.795 0.838 . . . . 0.0 111.219 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 34' ' ' VAL . 5.5 tppt? -72.84 -46.24 54.02 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 123.79 0.681 . . . . 0.0 109.409 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 98.9 mt -62.73 -32.17 73.23 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.637 174.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -67.28 -30.16 69.95 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.627 1.171 . . . . 0.0 111.803 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -93.4 -48.95 6.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.833 0.453 . . . . 0.0 110.658 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -65.05 -53.86 39.23 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.992 0.807 . . . . 0.0 111.334 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -110.37 -23.5 11.15 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.421 0.688 . . . . 0.0 112.088 -172.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.34 13.91 64.91 Favored Glycine 0 N--CA 1.478 1.477 0 CA-C-N 117.739 0.245 . . . . 0.0 112.837 -172.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.591 HG21 HG13 ' A' ' 95' ' ' VAL . 96.4 t -91.6 115.88 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.41 0.684 . . . . 0.0 110.224 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 15.2 t -149.27 169.68 20.21 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 124.247 1.019 . . . . 0.0 109.598 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.48 -2.79 87.63 Favored Glycine 0 C--N 1.345 1.057 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.564 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.425 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 27.8 m -98.36 17.75 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.699 1.2 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.58 -53.56 29.53 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.296 1.438 . . . . 0.0 112.172 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.15 -39.68 87.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.03 -23.05 61.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.992 0.917 . . . . 0.0 111.233 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HB2' HG13 ' A' ' 62' ' ' VAL . 81.7 mt -71.59 -33.48 69.09 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.404 0.682 . . . . 0.0 110.351 173.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -62.27 -40.23 95.53 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.602 0.564 . . . . 0.0 110.795 170.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.85 -24.07 63.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.322 0.649 . . . . 0.0 111.754 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.6 124.82 24.65 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 174.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -117.88 6.21 12.23 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.343 0.657 . . . . 0.0 109.324 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.7 p -145.38 143.44 30.11 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.893 0.877 . . . . 0.0 110.836 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.61 -32.09 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.646 172.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.72 -42.66 97.89 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.186 0.595 . . . . 0.0 111.633 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -27.79 63.63 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.502 0.321 . . . . 0.0 111.193 174.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -63.42 -38.65 91.96 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.346 0.258 . . . . 0.0 110.809 170.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -56.87 -58.44 8.14 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.399 0.679 . . . . 0.0 111.064 176.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -64.52 -29.7 70.73 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.826 0.704 . . . . 0.0 111.489 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.9 -56.71 10.39 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.517 0.511 . . . . 0.0 110.999 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.591 HG13 HG21 ' A' ' 75' ' ' VAL . 96.9 t -59.77 -48.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 O-C-N 123.73 0.644 . . . . 0.0 110.728 -177.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -65.22 -46.15 81.84 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.575 0.75 . . . . 0.0 112.869 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -65.06 -47.47 77.19 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.813 0.339 . . . . 0.0 110.41 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -74.48 -17.56 60.75 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.126 0.97 . . . . 0.0 111.968 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.555 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -80.79 -46.31 15.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.064 0.545 . . . . 0.0 109.91 176.494 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.1 -32.38 66.94 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.281 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.48 -158.01 0.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.765 1.226 . . . . 0.0 108.746 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 160.72 -60.8 0.3 Allowed Glycine 0 C--N 1.346 1.088 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.25 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 108.649 178.57 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.88 -163.53 52.07 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.613 0.571 . . . . 0.0 112.419 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.0 t -161.88 108.9 1.36 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.351 0.66 . . . . 0.0 109.659 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.5 t -80.71 121.28 25.69 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.733 0.813 . . . . 0.0 110.04 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -127.54 9.92 6.61 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.006 0.923 . . . . 0.0 109.729 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -83.17 132.65 35.07 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.816 0.847 . . . . 0.0 110.495 -169.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -162.61 178.1 8.84 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.068 0.947 . . . . 0.0 109.169 174.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -102.25 150.06 23.69 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.633 0.373 . . . . 0.0 110.372 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -142.4 41.78 1.62 Allowed 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 171.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -80.71 94.93 6.46 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.433 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -107.98 110.07 21.7 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.6 p -158.15 31.14 0.25 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.772 0.829 . . . . 0.0 109.894 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.65 79.7 0.81 Allowed Glycine 0 C--N 1.348 1.246 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.943 -173.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -97.38 106.69 19.05 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 170.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.95 91.44 5.42 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.314 0.578 . . . . 0.0 109.535 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -107.57 124.81 50.48 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.617 ' H ' HD23 ' A' ' 17' ' ' LEU . 1.1 pt? -65.5 90.75 0.11 Allowed 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 121.806 0.812 . . . . 0.0 111.559 -175.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -140.77 154.04 46.11 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.36 1.064 . . . . 0.0 109.356 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -94.15 116.94 29.41 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.289 0.635 . . . . 0.0 109.534 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -91.32 62.53 4.71 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 171.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.04 110.02 3.21 Favored Glycine 0 C--N 1.352 1.461 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.576 -176.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -124.04 -179.77 4.54 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.456 1.102 . . . . 0.0 109.705 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.426 ' SD ' ' N ' ' A' ' 23' ' ' MET . 0.9 OUTLIER -65.32 129.29 94.37 Favored Pre-proline 0 N--CA 1.475 0.808 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.402 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.39 38.23 0.48 Allowed 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 123.805 3.003 . . . . 0.0 114.976 -172.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -74.88 96.83 3.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 162.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -108.26 -179.82 3.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.172 0.989 . . . . 0.0 108.464 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -80.56 -4.91 55.77 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.912 0.885 . . . . 0.0 111.93 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -47.02 -63.2 1.1 Allowed 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -168.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.4 -26.22 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.302 0.641 . . . . 0.0 111.159 -178.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 m170 -75.52 -35.81 60.67 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.08 0.952 . . . . 0.0 111.018 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -77.73 -34.31 52.62 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.37 -31.43 71.66 Favored 'General case' 0 CA--C 1.559 1.323 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.138 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 m -67.53 -41.81 83.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.645 0.778 . . . . 0.0 110.717 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.66 -43.75 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.496 0.719 . . . . 0.0 110.788 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.16 -33.53 76.22 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.495 0.718 . . . . 0.0 111.199 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.2 t -64.38 -36.98 85.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.353 0.661 . . . . 0.0 111.22 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.41 -48.73 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.827 176.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.6 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -67.12 -29.34 69.04 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.161 0.985 . . . . 0.0 112.398 -171.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.407 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 84.5 p -91.15 -52.61 4.74 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.123 0.569 . . . . 0.0 109.518 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.29 -10.44 28.78 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.761 -175.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.403 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -80.61 156.91 72.85 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.212 0.605 . . . . 0.0 110.071 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.46 155.9 59.7 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.281 1.987 . . . . 0.0 112.546 172.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -60.27 -23.31 64.03 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.286 1.034 . . . . 0.0 112.077 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -63.53 -38.07 89.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.209 1.003 . . . . 0.0 111.713 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -87.1 -0.9 57.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.451 0.7 . . . . 0.0 112.347 -174.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.56 HG23 HD13 ' A' ' 55' ' ' LEU . 44.1 mt -98.36 137.86 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.166 0.586 . . . . 0.0 109.937 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 t -144.38 151.8 39.79 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.302 0.641 . . . . 0.0 109.367 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.434 ' NH1' ' HB2' ' A' ' 49' ' ' ASP . 5.0 ppt_? -62.78 -30.99 71.88 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 123.765 0.666 . . . . 0.0 109.667 167.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.434 ' HB2' ' NH1' ' A' ' 48' ' ' ARG . 34.5 t70 -83.42 80.22 9.16 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 123.55 0.74 . . . . 0.0 109.148 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.4 t -165.27 147.5 7.81 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.698 -177.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -85.82 27.27 0.88 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.292 0.637 . . . . 0.0 110.462 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 15.6 mmt 68.11 36.22 3.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.63 1.172 . . . . 0.0 110.023 -165.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -59.26 88.2 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.39 1.076 . . . . 0.0 111.726 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 64.91 11.33 6.91 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.164 1.385 . . . . 0.0 112.024 -178.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.56 HD13 HG23 ' A' ' 46' ' ' ILE . 83.9 mt -97.02 -40.96 8.6 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.553 0.741 . . . . 0.0 110.925 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.681 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -158.51 -167.15 2.08 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.839 0.856 . . . . 0.0 109.984 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.4 t80 81.84 -27.51 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 125.829 1.652 . . . . 0.0 112.098 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.7 136.49 56.87 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.584 0.754 . . . . 0.0 109.947 167.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.0 m -52.61 -44.0 65.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 112.967 -173.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.2 tp -69.73 -38.43 76.87 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.88 0.472 . . . . 0.0 110.818 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.6 HG13 ' HB1' ' A' ' 38' ' ' ALA . 49.1 t -66.86 -37.5 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.711 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.6 t -67.88 -34.38 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 123.343 0.657 . . . . 0.0 110.463 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.1 m -61.85 -49.43 76.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.198 0.599 . . . . 0.0 110.264 175.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -66.91 -37.71 84.86 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.107 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 55.3 tp -68.04 -43.64 78.23 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.774 0.829 . . . . 0.0 110.398 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.2 t -65.48 -43.01 91.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.42 0.688 . . . . 0.0 110.839 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.64 -36.58 84.29 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.124 0.89 . . . . 0.0 110.55 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -70.54 -50.93 32.42 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.334 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 95.7 mt -60.25 -38.38 83.3 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.613 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -59.0 -53.96 52.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.156 0.982 . . . . 0.0 112.17 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -84.91 -62.94 1.42 Allowed 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.818 0.342 . . . . 0.0 110.888 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -65.69 -47.76 74.36 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.008 0.923 . . . . 0.0 112.218 -166.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -91.2 -20.77 21.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.137 0.575 . . . . 0.0 111.813 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.55 0.57 89.38 Favored Glycine 0 C--N 1.352 1.429 0 N-CA-C 113.87 0.308 . . . . 0.0 113.87 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.88 108.82 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 124.286 1.034 . . . . 0.0 109.941 -177.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -133.27 166.47 22.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.155 0.582 . . . . 0.0 110.584 -176.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.29 18.02 79.76 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-N 116.334 -0.394 . . . . 0.0 112.475 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.9 m -110.42 15.79 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.484 1.114 . . . . 0.0 110.614 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.22 -45.24 88.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.709 1.204 . . . . 0.0 111.939 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.402 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 24.7 m-20 -68.35 -36.47 79.28 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.694 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.95 -27.96 64.12 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.188 0.595 . . . . 0.0 111.199 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 99.3 mt -74.32 -26.88 60.43 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.51 0.724 . . . . 0.0 110.853 175.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.11 -37.31 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.184 171.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 80' ' ' ASP . 86.9 mt -84.86 16.35 3.4 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.096 0.958 . . . . 0.0 112.636 -176.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.23 127.32 32.66 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.013 0.435 . . . . 0.0 111.231 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -93.07 -58.65 2.25 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.344 176.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.0 p -119.65 169.34 10.18 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.503 HG22 ' SD ' ' A' ' 52' ' ' MET . 47.6 t -70.07 -33.38 54.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.685 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.64 -40.01 90.38 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.031 0.933 . . . . 0.0 110.611 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -58.78 -43.13 90.33 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.357 1.063 . . . . 0.0 110.54 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 44.0 tp -61.37 -46.09 91.65 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.485 0.714 . . . . 0.0 111.945 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -58.73 -42.96 89.94 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 123.377 0.423 . . . . 0.0 111.081 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.28 -37.53 83.56 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.823 0.449 . . . . 0.0 111.481 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.51 -57.75 10.05 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.374 0.67 . . . . 0.0 110.903 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.15 -35.37 71.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.448 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.98 -45.04 90.82 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.206 1.002 . . . . 0.0 111.473 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -65.57 -41.3 93.09 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.807 -178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -79.97 -17.53 52.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.337 0.655 . . . . 0.0 111.975 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -72.22 -44.88 62.26 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.743 0.817 . . . . 0.0 109.453 174.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.29 -66.26 0.87 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.062 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.01 97.86 6.24 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.283 176.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 154.07 -53.58 0.45 Allowed Glycine 0 N--CA 1.461 0.319 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 CA--C 1.559 1.296 0 C-N-CA 125.089 1.355 . . . . 0.0 111.811 175.474 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.94 152.95 21.32 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 177.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m -75.24 101.11 4.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.511 0.724 . . . . 0.0 109.786 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.9 m -68.31 -50.6 52.36 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.604 0.762 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.8 m80 62.06 105.23 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.778 1.231 . . . . 0.0 111.663 -178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -115.86 146.32 42.11 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.73 0.812 . . . . 0.0 111.644 -174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -148.99 42.77 0.96 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.724 1.209 . . . . 0.0 109.839 176.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.1 73.23 3.68 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 122.074 0.94 . . . . 0.0 111.813 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -94.0 142.08 27.8 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 109.165 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -159.4 140.13 12.43 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 124.117 0.967 . . . . 0.0 108.772 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.7 m -142.5 102.47 4.08 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.262 0.625 . . . . 0.0 109.729 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 m -140.34 99.75 3.73 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.431 1.093 . . . . 0.0 108.372 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -128.42 84.62 0.33 Allowed Glycine 0 C--N 1.34 0.795 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -176.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -147.33 132.34 18.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.37 0.668 . . . . 0.0 110.127 174.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -161.15 128.19 4.08 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 175.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 68.65 162.08 0.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 124.146 0.904 . . . . 0.0 110.799 -173.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 tt 70.97 97.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.891 1.276 . . . . 0.0 108.54 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -109.62 155.45 21.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.713 0.805 . . . . 0.0 109.425 -177.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -72.8 -26.4 61.5 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 123.559 0.537 . . . . 0.0 110.689 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -82.1 -4.81 57.68 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.481 0.713 . . . . 0.0 111.601 175.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.32 -105.57 2.18 Favored Glycine 0 C--N 1.352 1.456 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -174.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -123.67 -61.76 1.36 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -102.31 115.64 64.21 Favored Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 173.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -60.94 176.22 1.04 Allowed 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.2 2.6 . . . . 0.0 113.508 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.72 86.86 0.12 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.674 1.589 . . . . 0.0 110.01 -173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -164.4 144.58 7.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.521 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -106.19 -36.95 6.73 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.604 0.761 . . . . 0.0 109.932 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -65.61 -62.97 1.21 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.391 0.677 . . . . 0.0 112.395 -166.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.85 -34.81 73.61 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.652 0.781 . . . . 0.0 110.85 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -68.58 -35.55 77.53 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.466 0.706 . . . . 0.0 111.636 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.502 HD21 ' HG ' ' A' ' 91' ' ' LEU . 59.2 tp -71.7 -36.6 70.6 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 tp -61.76 -36.93 82.46 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.918 0.887 . . . . 0.0 110.623 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 m -70.43 -40.0 74.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.837 0.855 . . . . 0.0 110.405 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.6 t -60.56 -38.79 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.902 0.881 . . . . 0.0 110.538 176.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 91' ' ' LEU . 95.9 mt -72.62 -33.95 67.01 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.753 0.821 . . . . 0.0 111.287 177.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.1 t -60.85 -38.09 84.34 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.468 0.48 . . . . 0.0 110.694 176.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.3 t -79.61 -37.14 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.686 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.56 71.52 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 0.0 111.979 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m -88.7 -40.33 13.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.595 0.758 . . . . 0.0 110.471 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.36 -32.02 7.36 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.0 -175.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.5 m -73.84 143.63 81.6 Favored Pre-proline 0 CA--C 1.556 1.189 0 C-N-CA 123.583 0.753 . . . . 0.0 110.233 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.93 168.9 8.12 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.849 2.366 . . . . 0.0 113.532 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -63.39 -25.71 68.41 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.984 0.913 . . . . 0.0 112.149 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -69.07 -27.91 66.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.384 1.074 . . . . 0.0 110.854 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -76.83 -23.09 52.77 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.823 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.578 HG23 HD13 ' A' ' 55' ' ' LEU . 21.2 mt -109.0 144.24 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.749 0.819 . . . . 0.0 110.222 -173.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.7 t -156.07 170.8 21.35 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.012 1.325 . . . . 0.0 108.135 174.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -62.27 -32.66 73.4 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.97 0.508 . . . . 0.0 110.417 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -95.04 -1.65 51.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.421 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.3 m -71.74 -6.15 39.2 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.028 0.531 . . . . 0.0 112.339 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 72.4 mtp85 68.47 170.45 0.28 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.872 1.269 . . . . 0.0 112.638 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.781 ' HG3' ' HB2' ' A' ' 57' ' ' PHE . 44.7 tpp -112.63 90.88 3.46 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.181 -172.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 57' ' ' PHE . 10.3 tp10 -109.84 -68.73 0.9 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.139 0.976 . . . . 0.0 109.921 176.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -116.18 -18.47 10.57 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.95 0.9 . . . . 0.0 110.824 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.578 HD13 HG23 ' A' ' 46' ' ' ILE . 84.3 mt -60.95 -32.75 72.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.268 1.027 . . . . 0.0 112.842 -171.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.504 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.37 13.96 0.06 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.393 0.677 . . . . 0.0 112.072 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.781 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 81.6 t80 -100.17 -32.22 11.01 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.538 0.335 . . . . 0.0 110.936 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -55.6 133.43 50.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.901 -0.571 . . . . 0.0 109.568 176.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.8 t -52.95 -37.86 61.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.371 1.069 . . . . 0.0 113.022 -170.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 53.1 tp -68.46 -43.98 75.83 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 123.48 0.488 . . . . 0.0 110.492 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.69 -28.53 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.4 t -67.34 -49.14 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.258 0.623 . . . . 0.0 110.241 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.9 m -63.59 -40.14 96.18 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 124.022 0.826 . . . . 0.0 110.718 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -67.14 -41.09 86.66 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.112 0.965 . . . . 0.0 111.051 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.5 HD22 ' HB1' ' A' ' 56' ' ' ALA . 35.0 tp -67.66 -48.87 65.44 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 123.453 0.47 . . . . 0.0 110.209 -175.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.0 t -64.22 -32.71 74.4 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.796 0.438 . . . . 0.0 110.742 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 9.9 tt -63.5 -52.36 61.58 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.243 1.017 . . . . 0.0 109.955 176.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.442 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.1 OUTLIER -74.09 -42.67 59.77 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.572 -173.312 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.505 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 60.8 mt -61.43 -28.99 69.66 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.101 176.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 45.9 ttp180 -57.16 -32.09 66.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.232 1.013 . . . . 0.0 111.681 177.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -97.14 -50.83 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.773 0.829 . . . . 0.0 111.046 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 25.4 mm-40 -62.28 -53.02 61.1 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.379 1.072 . . . . 0.0 112.226 -171.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -120.53 -4.36 9.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.219 0.607 . . . . 0.0 111.822 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.64 20.06 79.77 Favored Glycine 0 C--N 1.351 1.392 0 C-N-CA 123.364 0.507 . . . . 0.0 114.146 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.507 HG21 HG13 ' A' ' 95' ' ' VAL . 51.0 t -90.93 117.41 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.704 0.802 . . . . 0.0 109.532 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.8 m -145.41 150.25 36.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.008 0.923 . . . . 0.0 110.672 -171.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.41 15.8 78.96 Favored Glycine 0 C--N 1.359 1.825 0 O-C-N 123.555 0.534 . . . . 0.0 112.861 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.22 8.19 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.328 1.051 . . . . 0.0 111.055 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 3.1 m-20 -54.0 -43.04 69.72 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 125.206 1.403 . . . . 0.0 112.29 -173.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.3 -43.77 96.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 113.765 -1.561 . . . . 0.0 110.051 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 30.5 tt0 -73.43 -28.89 62.22 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.721 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.432 HD23 HD13 ' A' ' 94' ' ' LEU . 93.0 mt -62.8 -37.97 88.82 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.077 0.951 . . . . 0.0 110.265 176.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.29 -39.03 75.1 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.036 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.78 -14.21 62.88 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 94' ' ' LEU . 57.7 mt -70.82 123.2 21.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.887 0.475 . . . . 0.0 110.451 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' HG3' HG23 ' A' ' 87' ' ' THR . 10.7 pt-20 -93.12 -22.78 18.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.583 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.501 HG23 ' HG3' ' A' ' 86' ' ' GLU . 67.5 p -133.81 159.14 41.53 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.571 0.748 . . . . 0.0 111.122 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 t -69.22 -26.89 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.116 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 93' ' ' GLN . 33.0 t70 -61.11 -43.91 98.16 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.191 0.596 . . . . 0.0 110.408 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HB3' HD22 ' A' ' 85' ' ' LEU . 74.0 mm-40 -60.62 -32.38 71.52 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 123.882 0.739 . . . . 0.0 111.545 172.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 35' ' ' LEU . 34.0 tp -67.83 -41.41 83.07 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 175.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -60.8 -40.37 92.42 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.956 0.408 . . . . 0.0 109.927 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 89' ' ' ASP . 76.7 mt-30 -64.1 -40.41 96.17 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.117 174.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 85' ' ' LEU . 6.1 tt -59.64 -49.94 75.8 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.264 1.026 . . . . 0.0 110.907 -176.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.507 HG13 HG21 ' A' ' 75' ' ' VAL . 63.3 t -62.87 -50.81 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -65.11 -24.26 67.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 123.816 0.698 . . . . 0.0 112.435 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -67.33 -51.59 50.57 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.24 1.016 . . . . 0.0 109.854 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -82.49 -16.56 48.32 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.402 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -41.4 28.25 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.22 1.008 . . . . 0.0 109.33 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.35 -51.78 9.59 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.47 0.708 . . . . 0.0 110.677 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.54 97.66 9.7 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -150.4 37.3 0.91 Allowed Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.795 -0.522 . . . . 0.0 111.795 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.5 m . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 123.427 0.691 . . . . 0.0 109.505 178.568 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mtp . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.46 50.12 6.85 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 123.756 0.66 . . . . 0.0 113.703 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.6 m -69.44 98.91 1.16 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.474 0.709 . . . . 0.0 109.975 176.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.9 t -87.58 87.65 7.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.652 0.781 . . . . 0.0 109.657 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -123.51 74.11 1.23 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 175.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -134.36 24.07 3.78 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.04 0.936 . . . . 0.0 110.23 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -77.0 97.97 4.82 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.304 1.042 . . . . 0.0 110.373 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -123.09 127.87 49.33 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.54 1.136 . . . . 0.0 108.099 177.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.2 p-80 -69.47 110.03 4.54 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.498 0.666 . . . . 0.0 110.168 -179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -86.56 87.84 7.53 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.3 p -66.69 122.13 16.96 Favored 'General case' 0 C--N 1.352 0.675 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.081 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.2 m -106.8 151.23 25.46 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 123.63 0.772 . . . . 0.0 109.97 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.92 77.54 1.3 Allowed Glycine 0 C--N 1.348 1.23 0 O-C-N 123.808 0.692 . . . . 0.0 111.789 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.646 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 19.2 mmt180 -121.26 103.83 9.28 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.506 1.123 . . . . 0.0 109.703 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -64.24 99.68 0.29 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 0.0 111.231 -177.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 65.02 10.65 6.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.615 1.166 . . . . 0.0 112.839 175.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.646 ' HB2' ' HB3' ' A' ' 14' ' ' ARG . 88.3 mt -93.18 57.29 2.68 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.719 0.771 . . . . 0.0 109.351 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -150.47 69.11 0.98 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.353 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -68.75 -39.5 80.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.397 -1.274 . . . . 0.0 109.954 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -142.95 139.43 30.69 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.086 0.554 . . . . 0.0 110.008 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.7 -78.9 0.17 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -167.22 124.3 1.2 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.438 1.095 . . . . 0.0 108.877 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -86.61 144.92 38.25 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -52.5 128.03 26.39 Favored 'Trans proline' 0 C--N 1.38 2.225 0 C-N-CA 123.202 2.601 . . . . 0.0 112.94 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -103.09 23.3 12.55 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.313 0.645 . . . . 0.0 110.445 178.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.25 167.55 17.56 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.497 1.119 . . . . 0.0 110.921 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.0 ptm -60.65 -28.38 68.52 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.007 0.923 . . . . 0.0 111.767 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HA ' ' HE1' ' A' ' 92' ' ' PHE . 51.3 mt-10 -59.93 -53.03 62.69 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 123.347 0.659 . . . . 0.0 110.492 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.83 -34.79 78.97 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.241 -179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -64.11 -38.26 90.43 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.409 0.683 . . . . 0.0 111.867 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 58.3 mt -69.16 -38.55 78.79 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.175 0.512 . . . . 0.0 111.016 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tp -67.86 -37.39 81.77 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.952 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.6 m -76.13 -37.51 57.93 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.653 1.181 . . . . 0.0 110.936 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 31' ' ' LEU . 11.7 p -68.96 -35.4 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 117.78 0.264 . . . . 0.0 110.614 -176.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.406 HD22 ' HB2' ' A' ' 56' ' ' ALA . 91.0 mt -67.64 -39.74 84.6 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.543 173.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.1 t -59.65 -51.73 68.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.678 0.791 . . . . 0.0 111.733 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.4 t -71.04 -45.8 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 123.958 0.903 . . . . 0.0 111.335 -174.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.32 80.48 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.045 0.538 . . . . 0.0 111.627 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.6 m -85.93 -15.89 40.21 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.933 0.493 . . . . 0.0 111.666 178.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.02 6.73 89.02 Favored Glycine 0 C--N 1.352 1.468 0 C-N-CA 122.739 0.209 . . . . 0.0 113.495 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.752 HG21 HD23 ' A' ' 55' ' ' LEU . 27.1 m -88.44 161.52 42.37 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 124.923 1.289 . . . . 0.0 111.003 -178.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.23 149.03 92.11 Favored 'Trans proline' 0 C--N 1.367 1.529 0 C-N-CA 122.416 2.077 . . . . 0.0 111.36 162.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -70.04 -19.26 63.31 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.239 0.616 . . . . 0.0 110.53 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.37 -27.46 64.25 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.132 0.973 . . . . 0.0 112.65 172.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.83 -16.85 61.6 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.89 0.876 . . . . 0.0 111.454 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.13 125.19 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.666 0.786 . . . . 0.0 111.081 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.3 t -125.8 177.11 6.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.438 1.095 . . . . 0.0 108.066 168.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -68.52 -39.08 81.34 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 122.559 0.344 . . . . 0.0 110.982 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.36 -3.68 58.44 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.8 0.84 . . . . 0.0 112.025 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -72.36 164.69 25.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.229 0.612 . . . . 0.0 111.986 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 0.0 OUTLIER -110.38 132.39 54.22 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.377 0.608 . . . . 0.0 110.361 173.355 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 24.9 ptp -80.68 67.71 6.65 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 122.339 1.066 . . . . 0.0 109.104 171.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -86.14 -70.77 0.58 Allowed 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.54 -30.99 67.88 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 172.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.752 HD23 HG21 ' A' ' 41' ' ' VAL . 2.7 mp -91.07 140.52 29.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.592 1.157 . . . . 0.0 108.965 -173.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.462 ' HB3' ' HB2' ' A' ' 52' ' ' MET . . . 74.61 -37.32 0.35 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 170.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -63.53 -29.35 70.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.673 1.189 . . . . 0.0 113.726 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.11 135.88 48.75 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.491 0.717 . . . . 0.0 110.7 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 m -60.84 -33.08 72.5 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -171.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.17 -37.83 75.28 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.193 0.597 . . . . 0.0 109.964 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -72.57 -38.03 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.839 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.5 t -65.19 -34.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 C-N-CA 123.807 0.843 . . . . 0.0 110.328 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.4 t -62.68 -49.13 76.31 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.288 0.635 . . . . 0.0 109.82 178.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 9.1 tp10 -67.33 -41.88 84.53 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.172 0.589 . . . . 0.0 110.513 178.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.56 -44.46 96.99 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.678 1.191 . . . . 0.0 111.147 -177.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.6 p -65.79 -36.17 82.76 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.667 0.787 . . . . 0.0 110.991 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 96.9 mt -63.92 -40.6 96.85 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.913 0.758 . . . . 0.0 111.097 173.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 75.1 mmtt -67.58 -44.04 79.11 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.002 0.521 . . . . 0.0 111.076 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.5 mt -67.32 -35.68 79.91 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.582 0.353 . . . . 0.0 110.172 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -60.69 -39.37 88.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.958 1.303 . . . . 0.0 111.419 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' LEU . 74.2 mmtt -91.64 -68.06 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.926 0.49 . . . . 0.0 110.773 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -63.0 -42.66 99.91 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.249 1.02 . . . . 0.0 112.472 -169.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -98.08 -20.98 17.03 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.147 0.579 . . . . 0.0 111.041 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.89 -7.92 68.42 Favored Glycine 0 C--N 1.353 1.515 0 CA-C-O 119.893 -0.393 . . . . 0.0 113.16 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.449 HG21 HG13 ' A' ' 95' ' ' VAL . 68.9 t -75.75 98.4 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 124.534 1.133 . . . . 0.0 110.021 -175.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.7 m -109.17 154.86 21.76 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.485 1.114 . . . . 0.0 110.271 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.37 20.32 72.32 Favored Glycine 0 C--N 1.351 1.409 0 C-N-CA 123.251 0.453 . . . . 0.0 113.392 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.437 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 m -108.96 16.08 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.639 0.776 . . . . 0.0 110.982 -177.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.48 -56.89 14.96 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.099 1.359 . . . . 0.0 111.292 -175.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.33 -34.97 79.38 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.679 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -68.09 -30.69 69.92 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.636 0.775 . . . . 0.0 110.528 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 96.6 mt -70.4 -39.69 74.34 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.081 0.952 . . . . 0.0 110.96 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.62 -35.41 76.1 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.852 173.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.92 -19.99 53.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.5 0.72 . . . . 0.0 112.19 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.541 HD11 HD13 ' A' ' 94' ' ' LEU . 69.8 mt -67.88 138.65 56.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 117.95 0.341 . . . . 0.0 111.398 176.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -119.54 -38.07 3.05 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 123.364 0.665 . . . . 0.0 109.601 177.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 50.8 p -108.19 148.06 30.46 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 122.119 0.961 . . . . 0.0 112.164 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.452 HG12 ' CE2' ' A' ' 92' ' ' PHE . 34.0 t -65.71 -30.11 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 113.987 -1.46 . . . . 0.0 109.834 176.003 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.4 -46.49 80.15 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.067 0.947 . . . . 0.0 111.169 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.02 -32.99 74.73 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.264 176.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.98 -48.64 79.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 123.639 0.587 . . . . 0.0 111.902 174.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.452 ' CE2' HG12 ' A' ' 88' ' ' VAL . 64.3 m-85 -56.29 -45.09 80.33 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.235 0.614 . . . . 0.0 110.902 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 48.6 mt-30 -64.52 -49.24 72.07 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.944 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.541 HD13 HD11 ' A' ' 85' ' ' LEU . 8.5 tt -51.72 -57.85 8.08 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.053 1.341 . . . . 0.0 110.378 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.495 HG21 HD21 ' A' ' 31' ' ' LEU . 70.8 t -58.84 -38.75 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.657 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.5 -36.25 78.64 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.17 0.588 . . . . 0.0 111.906 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 34.3 mmtp -66.49 -39.26 88.64 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.214 0.606 . . . . 0.0 110.127 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.455 ' HA ' ' HA3' ' A' ' 102' ' ' GLY . 80.2 m80 -78.62 -24.69 45.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.134 0.574 . . . . 0.0 111.208 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -77.62 -32.31 53.37 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.362 0.665 . . . . 0.0 110.64 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.56 -62.12 1.32 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.674 0.79 . . . . 0.0 111.105 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -103.43 -9.4 19.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.638 -171.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 98' ' ' HIS . . . -100.12 46.17 1.41 Allowed Glycine 0 N--CA 1.474 1.23 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 -176.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--O 1.249 1.034 0 C-N-CA 123.842 0.857 . . . . 0.0 110.383 179.489 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 ttm . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.98 -127.67 9.3 Favored Glycine 0 C--N 1.348 1.243 0 N-CA-C 111.96 -0.456 . . . . 0.0 111.96 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.5 m -136.75 100.15 4.24 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.922 0.889 . . . . 0.0 109.751 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 58.6 p -80.13 114.51 19.09 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 174.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.2 m80 -86.52 -86.91 0.14 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 59.93 20.28 9.28 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.416 1.086 . . . . 0.0 113.44 169.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -110.8 173.42 6.34 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.579 0.751 . . . . 0.0 110.456 -177.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -148.66 131.73 16.3 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 108.433 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -85.66 -19.9 30.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.016 0.526 . . . . 0.0 111.401 -176.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 59.74 86.74 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.509 1.124 . . . . 0.0 110.579 -176.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.1 p -79.04 74.33 5.58 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.409 0.684 . . . . 0.0 110.593 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.6 t -176.4 161.82 2.27 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.975 1.31 . . . . 0.0 108.849 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.73 -72.53 0.13 Allowed Glycine 0 C--N 1.339 0.702 0 N-CA-C 111.879 -0.488 . . . . 0.0 111.879 177.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -131.05 155.75 46.36 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.484 0.714 . . . . 0.0 111.019 -174.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -158.77 88.52 0.91 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.225 1.01 . . . . 0.0 109.516 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -71.53 -56.46 5.85 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 66.2 tp -123.91 -40.61 2.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 172.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 18.2 t80 67.16 21.26 10.09 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.848 1.259 . . . . 0.0 110.602 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 62.38 25.19 15.03 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.938 1.295 . . . . 0.0 111.59 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.87 98.45 9.18 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 123.323 0.649 . . . . 0.0 109.521 -177.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.04 -102.05 1.4 Allowed Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.068 175.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -145.57 168.83 19.69 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.925 0.89 . . . . 0.0 110.827 -176.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 59.9 mtm -84.82 151.77 58.47 Favored Pre-proline 0 CA--C 1.549 0.935 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.23 173.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.19 85.11 0.26 Allowed 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 122.395 2.063 . . . . 0.0 111.531 174.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -88.38 93.24 9.46 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.051 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -166.1 143.13 5.24 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.161 0.584 . . . . 0.0 111.404 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 tmm? 40.63 -80.08 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 127.252 2.221 . . . . 0.0 113.151 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.47 ' O ' HD22 ' A' ' 32' ' ' LEU . 35.5 mt-10 -53.82 -48.63 69.72 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 123.941 0.896 . . . . 0.0 111.122 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.06 -47.05 78.67 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.159 0.912 . . . . 0.0 111.28 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.445 ' O ' HG23 ' A' ' 34' ' ' VAL . 55.4 t60 -73.19 -25.95 60.98 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.619 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.46 -40.02 85.33 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 0.9 OUTLIER -60.89 -40.48 93.22 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.513 0.325 . . . . 0.0 110.202 171.435 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -63.59 -37.99 89.41 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.556 0.742 . . . . 0.0 110.978 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 30' ' ' HIS . 61.1 t -62.61 -50.75 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 122.801 0.441 . . . . 0.0 109.852 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.74 -42.33 95.27 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 122.697 0.399 . . . . 0.0 111.593 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.2 p -64.69 -39.6 93.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.563 0.745 . . . . 0.0 111.96 -174.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.56 -31.33 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.293 175.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.97 -7.71 59.04 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 0.0 112.509 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -112.31 -61.54 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.426 0.69 . . . . 0.0 109.987 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.12 -34.42 2.26 Favored Glycine 0 C--N 1.341 0.84 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.292 -173.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.19 154.87 92.08 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 123.19 0.596 . . . . 0.0 111.1 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -55.23 152.57 30.75 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 123.008 2.472 . . . . 0.0 113.27 168.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.594 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 21.4 ptmt -69.71 -22.81 63.37 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.599 0.76 . . . . 0.0 111.817 -179.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -73.21 -25.4 60.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.336 0.654 . . . . 0.0 110.505 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -72.95 -18.58 61.37 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.446 0.698 . . . . 0.0 111.593 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.0 mt -102.19 124.23 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.312 0.645 . . . . 0.0 109.704 -177.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -133.42 -179.88 5.79 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.297 1.039 . . . . 0.0 108.723 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.497 ' HB3' ' HB2' ' A' ' 89' ' ' ASP . 5.5 mpt_? -58.85 -55.12 39.2 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.004 0.922 . . . . 0.0 111.585 -172.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -90.47 3.92 52.53 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 0.0 112.343 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.5 m -74.48 -0.76 18.55 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 49.7 mtt180 66.81 170.74 0.25 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 112.259 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.75 ' SD ' HD22 ' A' ' 91' ' ' LEU . 72.5 mtm -116.45 29.54 7.89 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.231 1.013 . . . . 0.0 108.973 168.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.98 -55.83 30.11 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.207 0.942 . . . . 0.0 110.795 -172.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -101.72 16.21 26.53 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.972 0.909 . . . . 0.0 110.568 177.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 74.4 mt -114.34 -68.14 0.95 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.842 0.457 . . . . 0.0 111.615 -171.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -112.24 -21.4 11.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -173.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -70.6 89.65 0.73 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.162 0.585 . . . . 0.0 110.32 -176.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -177.62 146.97 0.48 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.616 1.566 . . . . 0.0 108.213 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -56.49 -46.6 80.41 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.386 0.674 . . . . 0.0 112.049 -177.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.41 -37.84 63.24 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.022 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.19 -32.8 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.218 0.324 . . . . 0.0 111.736 -175.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.5 -37.42 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 171.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 70.7 m -67.25 -37.28 83.24 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.013 0.525 . . . . 0.0 111.272 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.43 -37.2 65.94 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.7 tp -66.68 -48.11 70.34 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.494 ' HB3' HD12 ' A' ' 82' ' ' LEU . 40.8 p -66.62 -33.23 75.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.216 0.607 . . . . 0.0 111.665 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 56.2 tp -69.31 -40.4 77.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.348 0.659 . . . . 0.0 110.516 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -71.99 -42.09 66.87 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.392 0.677 . . . . 0.0 110.39 -177.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 93.3 mt -66.57 -38.55 87.31 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.052 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -55.27 -45.08 76.16 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.582 1.153 . . . . 0.0 111.516 177.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.7 -66.51 0.69 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.762 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.94 -54.49 6.5 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.043 -165.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -89.5 -11.68 42.23 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.454 -174.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.57 -7.6 53.03 Favored Glycine 0 C--N 1.355 1.612 0 C-N-CA 123.836 0.731 . . . . 0.0 114.393 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.455 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 48.5 t -77.56 102.79 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.84 0.856 . . . . 0.0 110.777 -171.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 t -137.32 169.36 17.92 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.695 0.798 . . . . 0.0 110.313 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.01 14.62 78.7 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.538 -176.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 35.7 m -119.91 16.17 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.429 1.092 . . . . 0.0 111.274 -173.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -54.94 -44.76 74.58 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.04 0.936 . . . . 0.0 112.216 -173.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -67.07 -34.09 76.92 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.458 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.3 mp0 -67.43 -38.5 84.66 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.668 0.605 . . . . 0.0 110.381 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 66' ' ' SER . 97.7 mt -63.91 -31.47 72.66 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.333 0.653 . . . . 0.0 111.197 178.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -75.1 -35.02 61.8 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.512 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -69.84 -23.46 63.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.631 0.772 . . . . 0.0 111.384 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.602 HD11 HD13 ' A' ' 94' ' ' LEU . 95.1 mt -76.31 118.11 18.68 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 122.938 0.495 . . . . 0.0 110.475 178.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.87 -13.76 19.92 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.682 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -137.55 144.09 41.91 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 124.086 0.954 . . . . 0.0 111.477 -168.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.7 t -75.23 -23.66 17.2 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.06 -171.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.497 ' HB2' ' HB3' ' A' ' 48' ' ' ARG . 31.7 t70 -59.62 -50.06 75.36 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.452 0.644 . . . . 0.0 110.239 178.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -68.02 -31.56 71.32 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.319 -1.31 . . . . 0.0 110.556 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.75 HD22 ' SD ' ' A' ' 52' ' ' MET . 52.5 tp -64.33 -47.29 79.92 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 123.406 0.441 . . . . 0.0 111.586 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -56.73 -45.96 81.64 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.599 0.76 . . . . 0.0 109.881 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.78 -34.06 74.92 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.863 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.602 HD13 HD11 ' A' ' 85' ' ' LEU . 9.4 tt -70.32 -47.03 62.96 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.62 -48.69 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 123.42 0.688 . . . . 0.0 110.057 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.71 -36.34 80.45 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.602 0.761 . . . . 0.0 111.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -64.43 -48.65 74.54 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.306 0.642 . . . . 0.0 110.5 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -77.37 -18.45 57.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.695 0.798 . . . . 0.0 111.499 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -78.44 -46.46 19.73 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.482 0.713 . . . . 0.0 110.282 176.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.51 -62.27 1.58 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.36 0.664 . . . . 0.0 109.901 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -81.6 78.32 8.35 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.907 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -118.88 19.77 10.17 Favored Glycine 0 C--N 1.343 0.92 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.359 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 23.8 p . . . . . 0 CA--C 1.556 1.208 0 C-N-CA 123.973 0.909 . . . . 0.0 110.349 -179.572 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 mtm . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.85 -159.33 20.85 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 111.436 -0.665 . . . . 0.0 111.436 -174.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p 51.34 78.87 0.1 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.18 1.392 . . . . 0.0 112.219 -175.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.7 p -73.76 97.32 2.69 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.283 176.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.5 p80 -62.46 -34.98 77.88 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.287 0.635 . . . . 0.0 110.849 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.6 t70 65.67 157.86 0.1 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.558 1.543 . . . . 0.0 111.456 -178.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -72.82 -58.65 3.18 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 122.973 0.509 . . . . 0.0 110.129 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 54.59 83.2 0.08 Allowed 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.63 1.172 . . . . 0.0 113.564 170.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -117.66 123.71 46.79 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 172.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -113.67 74.48 0.87 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 174.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -86.59 83.21 7.66 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.387 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.6 p -140.09 165.14 28.16 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.734 0.814 . . . . 0.0 110.031 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.96 -109.33 0.89 Allowed Glycine 0 C--N 1.342 0.881 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -88.25 88.86 7.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.169 0.588 . . . . 0.0 109.841 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.7 142.39 27.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.916 0.887 . . . . 0.0 109.414 176.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -109.18 144.5 37.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.172 0.589 . . . . 0.0 110.576 -176.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.98 164.49 26.56 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.753 0.821 . . . . 0.0 111.08 176.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -90.54 171.4 9.43 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.933 0.893 . . . . 0.0 110.665 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -98.87 -44.79 6.22 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.866 0.866 . . . . 0.0 109.104 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -139.26 145.21 38.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.048 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.17 -74.74 0.25 Allowed Glycine 0 C--N 1.344 1.005 0 N-CA-C 111.504 -0.639 . . . . 0.0 111.504 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 63.3 14.06 7.52 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.012 1.325 . . . . 0.0 112.063 -175.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.6 ttt -162.59 80.66 1.74 Allowed Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.25 1.02 . . . . 0.0 108.418 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -85.46 -179.36 3.42 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.378 2.052 . . . . 0.0 111.539 173.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.2 t30 66.42 6.45 4.34 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.805 1.242 . . . . 0.0 112.015 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -92.26 147.66 22.75 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 118.111 -0.947 . . . . 0.0 109.124 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.45 ' SD ' ' NH1' ' A' ' 99' ' ' ARG . 20.1 ttt -18.9 -60.04 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 C-N-CA 127.427 2.291 . . . . 0.0 116.324 -169.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.87 -58.73 6.39 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.121 0.568 . . . . 0.0 110.555 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -62.09 -31.55 72.01 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.17 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.425 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.1 t60 -71.91 -31.68 66.63 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.63 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.3 -37.56 85.69 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.896 0.478 . . . . 0.0 109.713 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -65.09 -35.9 82.61 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.751 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.5 m -66.53 -41.66 88.44 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.238 0.615 . . . . 0.0 110.069 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 30' ' ' HIS . 43.9 t -58.76 -47.04 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.069 0.948 . . . . 0.0 110.294 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' HD23 ' A' ' 55' ' ' LEU . 98.2 mt -68.35 -37.69 80.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.342 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.7 t -64.6 -39.52 93.87 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.085 0.954 . . . . 0.0 111.253 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 65.7 t -78.7 -30.54 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.379 0.672 . . . . 0.0 110.201 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.93 -25.95 53.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.316 0.646 . . . . 0.0 112.156 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.5 p -108.26 -66.11 1.07 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.002 0.521 . . . . 0.0 110.151 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.06 -27.04 2.81 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-O 119.847 -0.418 . . . . 0.0 112.163 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.05 131.66 88.85 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.967 0.507 . . . . 0.0 110.813 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.66 158.82 26.53 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 123.304 2.669 . . . . 0.0 112.478 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -63.12 -21.1 65.96 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.719 0.808 . . . . 0.0 112.51 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -65.83 -26.16 67.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.765 0.826 . . . . 0.0 111.335 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -100.29 8.27 43.84 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.885 0.874 . . . . 0.0 111.914 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 HD21 ' A' ' 55' ' ' LEU . 38.4 mt -113.14 140.08 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.188 0.595 . . . . 0.0 109.876 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -151.55 173.33 14.75 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.517 1.127 . . . . 0.0 109.366 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -30.25 69.92 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.463 0.649 . . . . 0.0 110.0 169.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.39 15.58 10.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.526 1.13 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.486 ' HB3' HG21 ' A' ' 88' ' ' VAL . 47.9 t -70.22 -21.38 63.02 Favored 'General case' 0 C--N 1.358 0.976 0 O-C-N 122.052 -0.405 . . . . 0.0 110.452 171.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 56.45 23.18 7.19 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.834 1.253 . . . . 0.0 113.404 169.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.638 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 14.3 mmt 60.4 54.58 3.82 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.195 0.998 . . . . 0.0 111.928 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 50' ' ' SER . 20.0 mm-40 -68.8 -71.31 0.22 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.179 0.514 . . . . 0.0 110.208 177.315 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.03 -19.99 14.01 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.915 1.286 . . . . 0.0 109.837 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 35' ' ' LEU . 4.4 mp -93.15 133.12 36.65 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.21 1.004 . . . . 0.0 110.357 -168.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.638 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 68.38 -69.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.861 1.664 . . . . 0.0 112.051 176.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.578 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 43.9 t80 -56.79 90.84 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.342 1.457 . . . . 0.0 111.776 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.1 t70 176.14 146.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 106.513 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 56.2 p -56.84 -45.48 82.34 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.054 0.542 . . . . 0.0 112.271 -175.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.6 tp -70.37 -49.08 52.92 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.279 0.632 . . . . 0.0 110.867 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 18.5 t -71.53 -26.45 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 123.43 0.457 . . . . 0.0 111.322 -172.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.91 -43.96 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.506 0.722 . . . . 0.0 109.646 172.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.1 m -62.27 -36.5 82.25 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.468 0.651 . . . . 0.0 111.122 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 25.6 tt0 -75.22 -37.84 60.93 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.306 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 35.1 tp -65.47 -28.45 69.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.319 0.648 . . . . 0.0 110.673 176.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 58.2 m -63.07 -49.48 74.36 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.097 0.959 . . . . 0.0 110.553 175.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -75.19 -19.94 59.56 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 119.217 -0.421 . . . . 0.0 112.126 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.551 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 72.9 mmtt -64.43 -62.88 1.32 Allowed 'General case' 0 C--N 1.367 1.365 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.63 -30.46 69.88 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.524 1.129 . . . . 0.0 111.802 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -52.9 -49.24 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.913 1.285 . . . . 0.0 110.451 173.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -91.42 -24.5 19.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.52 0.728 . . . . 0.0 111.722 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -85.64 -52.98 5.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.821 0.848 . . . . 0.0 111.571 -166.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -117.58 -2.19 11.52 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.365 0.666 . . . . 0.0 110.848 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.5 -3.88 83.56 Favored Glycine 0 C--N 1.353 1.515 0 C-N-CA 122.992 0.329 . . . . 0.0 113.409 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.411 HG12 HG22 ' A' ' 78' ' ' VAL . 13.0 t -89.36 98.44 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.8 t -80.17 143.66 33.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.177 0.591 . . . . 0.0 112.336 -169.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.32 -87.22 0.5 Allowed Glycine 0 C--N 1.351 1.377 0 O-C-N 124.287 0.992 . . . . 0.0 112.872 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.584 HG12 ' HB3' ' A' ' 81' ' ' GLU . 3.5 t 62.3 21.93 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 C-N-CA 124.518 1.127 . . . . 0.0 110.032 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.07 -41.22 74.77 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.814 1.246 . . . . 0.0 112.663 -168.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -62.08 -44.87 95.73 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 123.875 0.734 . . . . 0.0 111.009 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.584 ' HB3' HG12 ' A' ' 78' ' ' VAL . 8.4 tp10 -72.61 -47.88 44.15 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.186 -175.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.87 -30.61 70.98 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.971 0.908 . . . . 0.0 111.475 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.76 -44.89 80.21 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.508 0.723 . . . . 0.0 110.476 171.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -71.57 -27.75 63.37 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.901 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 80.0 mt -66.67 111.98 3.95 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.384 0.611 . . . . 0.0 110.791 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -100.52 -22.07 15.12 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.285 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.96 149.22 50.43 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.377 0.671 . . . . 0.0 111.286 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.486 HG21 ' HB3' ' A' ' 50' ' ' SER . 45.0 t -66.0 -28.42 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.218 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 17.7 t70 -60.04 -41.46 92.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 122.761 0.424 . . . . 0.0 110.559 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.44 -29.9 69.49 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.23 0.612 . . . . 0.0 111.625 175.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 69.3 tp -64.74 -39.37 93.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.557 0.343 . . . . 0.0 110.623 171.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.72 -41.07 98.14 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.773 0.429 . . . . 0.0 110.522 174.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 73.6 mm-40 -62.45 -42.13 99.24 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.817 0.447 . . . . 0.0 110.509 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.582 HD13 ' HG2' ' A' ' 81' ' ' GLU . 42.3 tp -59.65 -61.01 2.94 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.057 0.943 . . . . 0.0 110.897 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 87.7 t -64.44 -40.75 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.151 0.581 . . . . 0.0 111.099 -172.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.02 -53.57 24.91 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.52 0.728 . . . . 0.0 110.246 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -66.51 -36.07 81.8 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.396 0.678 . . . . 0.0 111.707 -174.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 -84.7 -22.53 29.73 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.45 ' NH1' ' SD ' ' A' ' 27' ' ' MET . 46.5 ttt180 -74.62 -37.85 62.71 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.46 -51.88 52.1 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.791 0.837 . . . . 0.0 110.244 172.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 67.23 -69.77 0.13 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.464 1.906 . . . . 0.0 112.118 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 87.93 14.72 62.33 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 111.782 -0.527 . . . . 0.0 111.782 -174.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--O 1.249 1.039 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -176.338 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.9 mtm . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.28 146.67 11.68 Favored Glycine 0 C--N 1.345 1.083 0 N-CA-C 112.193 -0.363 . . . . 0.0 112.193 -177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 p -162.46 106.72 1.15 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.406 1.083 . . . . 0.0 108.985 176.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.9 m -120.6 26.17 9.31 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.029 0.932 . . . . 0.0 111.058 -178.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -70.93 101.09 2.08 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -154.52 151.78 29.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.364 1.066 . . . . 0.0 109.381 -174.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -126.46 149.37 49.35 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.969 0.908 . . . . 0.0 110.326 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -75.99 137.53 40.34 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.672 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -92.72 132.58 36.81 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -70.73 111.09 5.92 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.364 0.665 . . . . 0.0 111.139 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -79.99 142.83 34.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.865 0.866 . . . . 0.0 110.131 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.8 p -150.74 131.68 14.23 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.716 0.806 . . . . 0.0 110.222 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.35 73.74 0.25 Allowed Glycine 0 C--N 1.345 1.074 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 177.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -78.99 74.74 5.51 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.027 0.931 . . . . 0.0 109.099 -179.071 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -88.86 -25.55 22.1 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.128 -174.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -125.49 168.25 13.89 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.447 1.099 . . . . 0.0 110.608 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.33 89.51 6.09 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -66.02 106.26 1.55 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.428 -178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -156.04 141.05 17.31 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.079 0.552 . . . . 0.0 110.481 -175.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -151.44 170.2 20.17 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.749 1.22 . . . . 0.0 108.775 172.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.33 -59.34 2.57 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 177.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 56.46 -100.41 0.11 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 124.905 1.282 . . . . 0.0 110.497 -177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -147.57 163.17 28.99 Favored Pre-proline 0 N--CA 1.48 1.062 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.83 170.93 1.75 Allowed 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.918 1.745 . . . . 0.0 113.205 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.489 ' H ' ' HB3' ' A' ' 29' ' ' ASP . 2.8 m-20 80.25 -98.57 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.437 1.895 . . . . 0.0 110.962 -177.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 51.99 -82.59 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 0.0 112.404 -172.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.5 tmm? -143.07 -51.57 0.36 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.927 0.891 . . . . 0.0 108.929 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.19 -61.83 2.1 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 124.054 0.846 . . . . 0.0 111.721 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 30.5 t70 -69.85 -24.69 63.48 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.881 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -65.77 -33.45 75.9 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.429 0.692 . . . . 0.0 110.477 170.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 91' ' ' LEU . 10.4 tt -68.8 -37.05 78.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.071 0.548 . . . . 0.0 110.079 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.566 HD23 ' HA ' ' A' ' 29' ' ' ASP . 2.6 mm? -62.77 -34.98 78.38 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 123.03 0.206 . . . . 0.0 111.144 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 37' ' ' VAL . 11.9 m -63.22 -42.22 99.24 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.457 0.703 . . . . 0.0 110.609 176.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.526 HG13 ' HG2' ' A' ' 68' ' ' LYS . 41.4 t -63.82 -43.07 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.38 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.02 -39.44 93.4 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.049 0.54 . . . . 0.0 111.484 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.5 p -68.15 -31.56 71.22 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.484 0.49 . . . . 0.0 111.682 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 33' ' ' THR . 87.8 t -75.04 -39.87 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.058 0 C-N-CA 122.876 0.47 . . . . 0.0 110.155 174.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.58 -29.94 62.71 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.649 0.78 . . . . 0.0 112.244 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.6 p -94.42 -53.78 3.78 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.192 0.597 . . . . 0.0 110.147 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.55 -15.04 9.89 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.951 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.8 m -92.67 145.72 30.9 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.363 0.665 . . . . 0.0 110.523 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -51.25 158.16 3.83 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.836 3.024 . . . . 0.0 115.162 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -63.35 -22.83 67.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.473 1.109 . . . . 0.0 111.984 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.42 -29.21 68.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.785 0.434 . . . . 0.0 111.147 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.62 0.56 56.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.601 0.761 . . . . 0.0 111.0 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.469 HG22 HD12 ' A' ' 32' ' ' LEU . 34.9 mt -129.82 105.96 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 123.674 0.789 . . . . 0.0 110.751 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.8 t -110.72 -177.77 3.31 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.737 0.815 . . . . 0.0 109.172 170.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.9 ptp85 -67.11 -33.36 75.3 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 173.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -70.43 -19.48 62.98 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.235 1.014 . . . . 0.0 111.3 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 m -66.44 149.23 50.73 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.873 0.844 . . . . 0.0 111.499 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.569 ' HD3' HG22 ' A' ' 87' ' ' THR . 16.4 mmt180 -82.98 -161.45 0.49 Allowed 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.183 178.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 49.5 mtt -130.99 -2.61 4.04 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.94 -10.92 23.98 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 118.833 0.742 . . . . 0.0 112.698 -173.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -141.88 26.57 1.88 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.746 0.818 . . . . 0.0 109.675 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 72.5 mt -136.35 -32.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.701 0.8 . . . . 0.0 112.616 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.51 -41.32 0.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 122.797 0.439 . . . . 0.0 112.0 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -61.28 87.78 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.925 1.29 . . . . 0.0 111.242 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 175.38 133.12 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.238 1.815 . . . . 0.0 106.307 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.3 m -52.29 -38.22 57.75 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 119.026 0.83 . . . . 0.0 113.17 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.04 -41.23 62.12 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.472 0.709 . . . . 0.0 111.141 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.9 t -76.98 -24.84 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 122.317 0.247 . . . . 0.0 110.627 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.0 -39.95 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 171.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.2 t -62.92 -43.61 98.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.631 0.772 . . . . 0.0 111.009 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -72.53 -38.36 68.05 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.567 0.747 . . . . 0.0 111.376 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.14 -46.09 75.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.291 0.636 . . . . 0.0 109.795 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.7 t -63.37 -31.8 73.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.123 0.969 . . . . 0.0 111.258 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.66 -46.57 87.61 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.526 ' HG2' HG13 ' A' ' 34' ' ' VAL . 0.1 OUTLIER -71.67 -35.88 70.45 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.461 -177.257 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.53 -42.55 78.33 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.847 0.459 . . . . 0.0 110.011 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 76' ' ' THR . 2.0 tmt_? -64.56 -48.22 75.83 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.302 1.041 . . . . 0.0 110.221 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -82.31 -67.13 0.81 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.312 -175.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -77.77 -47.73 18.28 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.84 -164.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.464 ' CE1' HG21 ' A' ' 34' ' ' VAL . 80.2 m-85 -79.53 -24.43 42.2 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.047 0.539 . . . . 0.0 110.982 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.0 -5.22 83.64 Favored Glycine 0 C--N 1.349 1.287 0 O-C-N 123.279 0.362 . . . . 0.0 113.369 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 HG21 ' A' ' 78' ' ' VAL . 40.7 t -81.9 87.92 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.271 1.029 . . . . 0.0 108.681 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 45.8 p -71.16 134.63 47.1 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.963 -168.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.62 -110.24 3.02 Favored Glycine 0 C--N 1.348 1.227 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.291 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG11 HD21 ' A' ' 94' ' ' LEU . 10.2 t 69.46 8.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 125.571 1.549 . . . . 0.0 110.823 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -48.61 -41.78 32.01 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.387 1.475 . . . . 0.0 113.146 -168.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.52 -46.91 71.48 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.365 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -73.91 -25.0 59.77 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.69 0.396 . . . . 0.0 110.838 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.15 -32.62 70.67 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.978 0.911 . . . . 0.0 110.418 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -68.21 -36.29 79.32 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.072 171.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.91 -1.75 36.66 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.542 0.737 . . . . 0.0 112.589 177.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.495 HD11 HD13 ' A' ' 94' ' ' LEU . 65.7 mt -80.76 151.81 28.62 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.284 0.493 . . . . 0.0 111.599 176.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -132.45 -44.81 0.91 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 109.361 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.569 HG22 ' HD3' ' A' ' 51' ' ' ARG . 64.1 p -117.4 156.4 27.98 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.443 0.697 . . . . 0.0 110.852 -177.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 90.6 t -67.9 -33.16 59.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.15 174.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.22 -38.96 81.24 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.089 0.956 . . . . 0.0 110.589 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.07 -31.88 66.52 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.147 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 31' ' ' LEU . 44.1 tp -67.39 -33.9 76.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.124 0.57 . . . . 0.0 110.874 173.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -68.32 -38.96 82.08 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.93 0.492 . . . . 0.0 110.945 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -69.01 -29.18 67.31 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 175.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.495 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -65.24 -59.52 3.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.648 0.779 . . . . 0.0 109.31 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 86.0 t -58.67 -30.88 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.004 0.922 . . . . 0.0 111.076 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.98 -52.84 63.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.12 0.968 . . . . 0.0 111.097 175.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -68.9 -30.05 68.45 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.533 0.733 . . . . 0.0 111.331 -177.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -83.14 -17.46 42.92 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.699 0.8 . . . . 0.0 111.612 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -83.22 -33.76 26.04 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.77 -35.59 72.68 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.718 0.807 . . . . 0.0 110.631 177.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -151.08 111.41 4.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.4 1.08 . . . . 0.0 108.126 175.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.27 23.56 3.28 Favored Glycine 0 N--CA 1.483 1.796 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 -174.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 6.8 p . . . . . 0 CA--C 1.554 1.114 0 C-N-CA 125.179 1.392 . . . . 0.0 108.067 178.583 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.73 54.13 0.01 OUTLIER Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.0 t -146.41 141.87 27.6 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.948 0.899 . . . . 0.0 109.782 -178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.7 p -80.37 105.84 11.93 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -81.67 164.86 21.51 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 110.153 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -62.13 -51.22 68.76 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.707 0.63 . . . . 0.0 111.944 -172.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -160.18 170.84 20.34 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 120.97 0.414 . . . . 0.0 111.216 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -127.01 140.69 52.12 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.525 1.13 . . . . 0.0 109.619 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -158.35 116.74 3.03 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.877 . . . . 0.0 109.091 175.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -95.25 124.93 39.54 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -91.02 59.41 4.04 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.656 0.741 . . . . 0.0 109.122 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.4 p -151.63 177.95 9.84 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.99 -174.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 85.8 -64.57 4.07 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 -178.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -87.1 -176.42 5.7 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.711 0.805 . . . . 0.0 110.039 174.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 62.97 24.02 14.33 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.484 1.114 . . . . 0.0 110.028 -178.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -93.24 10.09 33.38 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.414 1.085 . . . . 0.0 111.001 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mp -77.7 99.95 6.03 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.042 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -77.67 138.84 39.31 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.502 0.721 . . . . 0.0 110.412 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -74.54 -26.7 60.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.825 0.85 . . . . 0.0 110.96 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -97.27 26.89 4.48 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.057 0.943 . . . . 0.0 110.534 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -153.51 107.77 0.34 Allowed Glycine 0 C--N 1.343 0.953 0 N-CA-C 111.782 -0.527 . . . . 0.0 111.782 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -71.1 -47.54 57.53 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.238 0.519 . . . . 0.0 110.217 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 83.0 mtp -148.04 105.8 3.63 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 124.792 1.237 . . . . 0.0 108.397 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.74 144.57 49.15 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 122.061 1.841 . . . . 0.0 111.325 173.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -71.44 -19.96 62.16 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.371 0.668 . . . . 0.0 109.844 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.5 t70 74.83 148.8 0.1 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.608 1.563 . . . . 0.0 112.061 171.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 19.7 ttt -70.42 -54.83 10.8 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.425 176.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -61.67 -57.73 10.82 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.222 1.009 . . . . 0.0 112.784 -167.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.65 -43.09 99.51 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.558 0.536 . . . . 0.0 110.679 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -67.2 -32.0 72.77 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.048 0.842 . . . . 0.0 111.308 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 24.1 tp -64.83 -45.06 87.72 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.36 -31.24 72.26 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.202 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.3 m -67.66 -42.13 82.67 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.829 0.452 . . . . 0.0 109.939 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' HG3' ' A' ' 68' ' ' LYS . 22.3 t -60.84 -44.57 97.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.352 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 53.6 mt -67.94 -32.18 72.45 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.693 0.62 . . . . 0.0 110.908 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.3 t -64.84 -35.94 82.73 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.857 0.723 . . . . 0.0 111.072 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.2 t -82.92 -25.55 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.898 0.879 . . . . 0.0 110.68 178.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -82.91 -27.56 30.55 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.463 0.705 . . . . 0.0 111.904 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.1 p -107.07 -55.28 2.35 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.056 0.542 . . . . 0.0 110.544 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 130.86 -29.84 3.48 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.47 -178.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 m -79.03 140.9 57.91 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.685 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.515 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 37.7 Cg_endo -63.86 170.53 8.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.108 2.539 . . . . 0.0 113.323 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.21 -22.11 66.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.074 0.95 . . . . 0.0 111.705 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.68 -29.38 66.8 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.105 0.562 . . . . 0.0 110.835 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 11.4 mm-40 -92.5 6.33 47.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.346 0.658 . . . . 0.0 110.755 176.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -127.22 99.23 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.1 0.96 . . . . 0.0 108.821 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.495 ' OG ' ' HB2' ' A' ' 50' ' ' SER . 57.8 p -98.68 150.64 21.57 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -66.68 -24.29 66.25 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.9 0.88 . . . . 0.0 112.2 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -99.68 1.2 43.25 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.912 0.885 . . . . 0.0 111.18 -175.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.495 ' HB2' ' OG ' ' A' ' 47' ' ' SER . 9.0 t -83.35 170.21 14.81 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 123.438 0.695 . . . . 0.0 111.921 -176.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -67.68 147.65 52.38 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.149 165.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.652 ' HG3' ' HB2' ' A' ' 55' ' ' LEU . 19.8 ttt -102.29 -77.73 0.55 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.296 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 38.07 -80.07 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 113.896 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.12 -30.02 64.03 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.052 0.541 . . . . 0.0 112.218 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.652 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 51.1 mt -70.75 -25.5 62.94 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.448 0.699 . . . . 0.0 112.345 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -170.35 96.6 0.25 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.067 0.947 . . . . 0.0 110.766 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -168.07 49.19 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 177.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.402 ' O ' HG23 ' A' ' 62' ' ' VAL . 10.5 t70 -161.94 134.81 6.02 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.986 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.6 p -47.71 -46.7 29.87 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.647 1.179 . . . . 0.0 113.377 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.34 -39.81 74.47 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.588 0.355 . . . . 0.0 110.789 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.31 -34.86 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 123.254 0.347 . . . . 0.0 110.666 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.54 HG13 ' HB2' ' A' ' 82' ' ' LEU . 75.0 t -69.51 -39.06 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.914 0.885 . . . . 0.0 110.203 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.3 m -64.47 -44.58 90.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.402 0.681 . . . . 0.0 110.09 175.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -64.89 -44.84 88.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.28 1.032 . . . . 0.0 110.819 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.0 tp -69.21 -38.7 78.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.036 0.934 . . . . 0.0 110.407 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.0 t -61.13 -38.66 87.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.471 0.709 . . . . 0.0 110.68 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.497 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 94.0 mt -63.55 -48.75 76.21 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.875 0.735 . . . . 0.0 110.625 175.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.506 ' HG3' HG13 ' A' ' 34' ' ' VAL . 75.3 mmtt -59.72 -47.77 84.34 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.093 0.557 . . . . 0.0 111.196 -178.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.58 -29.78 69.22 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.516 0.727 . . . . 0.0 111.347 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.69 -53.06 37.63 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.197 0.999 . . . . 0.0 111.115 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 4.0 mptp? -72.4 -41.54 66.16 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.557 -177.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -82.2 -53.99 5.62 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.303 0.641 . . . . 0.0 112.175 -170.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -107.14 -14.77 14.83 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.157 0.583 . . . . 0.0 112.063 -171.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.28 -6.14 77.46 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 122.908 0.29 . . . . 0.0 112.885 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.577 HG12 HG21 ' A' ' 78' ' ' VAL . 46.0 t -80.93 80.12 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.082 0.953 . . . . 0.0 109.821 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 t -91.32 160.75 15.34 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.28 0.632 . . . . 0.0 111.251 -174.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.49 -110.97 3.15 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.577 HG21 HG12 ' A' ' 75' ' ' VAL . 3.4 t 58.15 26.19 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 125.231 1.412 . . . . 0.0 111.1 173.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -51.37 -57.67 8.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.25 1.42 . . . . 0.0 112.987 -166.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-20 -60.0 -43.49 95.17 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.071 0.857 . . . . 0.0 110.88 -176.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HB2' HG12 ' A' ' 78' ' ' VAL . 38.4 mt-10 -69.77 -40.95 75.77 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.036 0.535 . . . . 0.0 111.105 -173.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.54 ' HB2' HG13 ' A' ' 62' ' ' VAL . 76.6 mt -69.95 -25.16 63.51 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.948 0.499 . . . . 0.0 111.177 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.79 -16.51 31.93 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.181 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 0.3 OUTLIER -99.31 10.31 41.67 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.802 0.841 . . . . 0.0 110.052 -177.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.477 HD11 HD13 ' A' ' 91' ' ' LEU . 24.7 mt -69.29 115.46 8.58 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -173.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -91.23 -53.41 4.37 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.07 -178.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.5 p -127.04 158.41 37.03 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.795 0.838 . . . . 0.0 110.714 -177.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -66.06 -38.55 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -56.46 -34.23 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.328 1.051 . . . . 0.0 111.533 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.2 -40.62 86.49 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.264 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.477 HD13 HD11 ' A' ' 85' ' ' LEU . 63.4 tp -64.1 -34.46 78.08 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 123.673 0.608 . . . . 0.0 111.472 176.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -59.99 -52.53 65.01 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.798 0.439 . . . . 0.0 110.733 174.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -71.72 -19.29 62.07 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.792 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.545 HD21 HG11 ' A' ' 78' ' ' VAL . 8.2 tt -71.74 -57.69 4.14 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.706 0.802 . . . . 0.0 109.106 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.91 -31.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.325 0.65 . . . . 0.0 110.101 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -70.61 -37.71 73.87 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.631 0.773 . . . . 0.0 109.684 174.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.992 0.517 . . . . 0.0 109.822 177.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -72.9 -32.42 65.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.748 0.819 . . . . 0.0 111.25 176.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -66.09 -44.89 83.08 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.614 0.766 . . . . 0.0 110.096 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.58 64.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.286 1.034 . . . . 0.0 110.535 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.62 -17.83 61.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.481 0.712 . . . . 0.0 111.144 175.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 62.54 3.87 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.466 0.479 . . . . 0.0 112.45 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 CA--C 1.554 1.121 0 C-N-CA 124.1 0.96 . . . . 0.0 109.101 -178.774 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -170.69 151.57 16.48 Favored Glycine 0 C--N 1.34 0.752 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.3 p -137.66 160.52 38.97 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.419 0.688 . . . . 0.0 110.688 -178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -111.89 80.85 1.37 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.803 0.841 . . . . 0.0 109.469 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -99.7 -52.03 3.57 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 68.13 144.57 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.348 1.459 . . . . 0.0 113.047 173.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -113.35 8.81 18.11 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.045 171.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.5 t60 -73.65 97.95 2.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.303 1.041 . . . . 0.0 110.176 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -158.04 116.53 3.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.413 0.685 . . . . 0.0 110.365 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -98.23 147.6 24.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.028 0.931 . . . . 0.0 109.505 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.0 t -135.2 166.89 22.05 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.411 0.684 . . . . 0.0 109.816 173.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.7 t -152.93 172.82 16.22 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.257 1.023 . . . . 0.0 108.693 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 175.49 126.53 0.95 Allowed Glycine 0 C--N 1.339 0.702 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -119.17 154.11 33.83 Favored 'General case' 0 C--O 1.247 0.926 0 C-N-CA 123.489 0.716 . . . . 0.0 110.475 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -69.73 114.95 8.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.531 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -94.09 127.54 39.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.644 0.378 . . . . 0.0 110.009 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 98.2 mt -119.67 104.54 10.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.574 0.749 . . . . 0.0 109.074 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -120.42 137.02 54.55 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.238 1.015 . . . . 0.0 109.204 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -68.65 110.72 4.39 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 123.596 0.758 . . . . 0.0 110.14 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -88.03 98.68 11.66 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.573 0.749 . . . . 0.0 109.389 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.29 107.07 2.87 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.354 -0.385 . . . . 0.0 112.325 178.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -164.51 100.57 0.81 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.442 1.097 . . . . 0.0 108.232 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tpt -76.01 111.5 15.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.706 0.803 . . . . 0.0 109.504 177.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -86.66 83.74 1.11 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 122.831 2.354 . . . . 0.0 111.651 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -137.39 83.22 1.98 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.695 0.798 . . . . 0.0 109.426 -175.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -164.38 150.21 10.59 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.032 0.533 . . . . 0.0 109.993 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ttt -57.29 -52.56 64.83 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.866 0.867 . . . . 0.0 111.174 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.427 ' HG2' ' CE1' ' A' ' 92' ' ' PHE . 9.2 tm-20 -62.37 -39.92 94.76 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.879 0.872 . . . . 0.0 109.857 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -59.16 -50.78 72.73 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.225 0.61 . . . . 0.0 111.119 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 34' ' ' VAL . 34.8 m-70 -64.74 -36.47 84.4 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.267 0.627 . . . . 0.0 110.886 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.48 -37.41 74.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.76 -28.66 63.79 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.997 0.919 . . . . 0.0 110.187 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.6 m -71.98 -42.65 66.26 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.278 1.031 . . . . 0.0 109.952 174.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 30' ' ' HIS . 37.1 t -55.3 -46.14 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 123.567 0.747 . . . . 0.0 109.966 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.403 HD21 HD23 ' A' ' 91' ' ' LEU . 94.7 mt -62.14 -43.49 98.71 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.042 176.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.4 t -65.07 -34.83 79.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.033 0.933 . . . . 0.0 111.892 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.02 -37.45 17.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.481 0.712 . . . . 0.0 109.984 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.85 -26.83 59.97 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.649 0.78 . . . . 0.0 111.861 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.401 ' OG ' HG22 ' A' ' 41' ' ' VAL . 83.8 p -96.46 -41.57 8.52 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.625 0.77 . . . . 0.0 110.68 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.65 -15.11 62.42 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.374 -173.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.401 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -86.76 147.05 42.56 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 123.16 0.584 . . . . 0.0 110.342 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -52.78 155.52 10.59 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.128 2.552 . . . . 0.0 113.956 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -63.57 -26.17 68.57 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.292 0.637 . . . . 0.0 111.139 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.01 -31.14 71.49 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.794 0.838 . . . . 0.0 111.413 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.57 -30.44 64.4 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.511 0.724 . . . . 0.0 110.537 176.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -89.67 97.12 6.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.889 -174.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -79.58 156.92 27.48 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 167.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' O ' HG23 ' A' ' 88' ' ' VAL . 3.0 mpt_? -68.49 -30.28 69.07 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.22 87.04 6.35 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.2 t -142.83 142.57 31.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.708 0.803 . . . . 0.0 108.898 172.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -85.86 18.24 3.05 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.011 0.924 . . . . 0.0 112.013 -176.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 49.1 mtt 60.72 24.45 14.29 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 124.287 1.035 . . . . 0.0 112.188 176.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -32.92 -58.61 0.36 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 126.286 1.834 . . . . 0.0 113.497 -169.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.72 9.75 4.64 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.389 -0.823 . . . . 0.0 108.901 172.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.03 -42.4 17.53 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.701 0.8 . . . . 0.0 112.028 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -150.5 -1.94 0.38 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -86.31 76.56 9.66 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -179.8 136.3 0.12 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.275 1.43 . . . . 0.0 108.32 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.2 p -58.23 -36.84 73.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.134 0.974 . . . . 0.0 113.144 -173.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.39 -38.37 74.68 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.9 t -71.58 -31.13 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.413 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 66.7 t -69.33 -34.58 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.693 0.797 . . . . 0.0 110.168 174.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.6 t -73.76 -33.72 64.4 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.192 0.597 . . . . 0.0 110.585 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.7 -39.91 84.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.354 0.661 . . . . 0.0 109.538 173.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD11 HD21 ' A' ' 91' ' ' LEU . 59.3 tp -63.22 -51.87 64.5 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.62 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 62.0 p -62.63 -36.32 82.43 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.874 0.87 . . . . 0.0 111.376 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.9 tp -64.95 -41.72 95.25 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.741 0.65 . . . . 0.0 110.854 175.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -69.09 -35.94 77.04 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.289 0.635 . . . . 0.0 111.271 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 88.2 mt -67.75 -32.9 73.82 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.911 0.485 . . . . 0.0 110.038 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -30.88 71.9 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.768 1.227 . . . . 0.0 111.289 175.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -93.59 -61.77 1.49 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.089 0.555 . . . . 0.0 111.335 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -61.6 -47.76 84.0 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.701 1.2 . . . . 0.0 112.063 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -108.64 -18.88 13.61 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 -172.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.2 -13.41 54.92 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-O 120.095 -0.281 . . . . 0.0 113.25 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.61 100.57 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.764 0.826 . . . . 0.0 109.206 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 39.7 m -90.78 141.38 28.87 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.836 0.854 . . . . 0.0 111.794 -169.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.39 -107.72 2.68 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.819 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 81' ' ' GLU . 3.7 t 64.55 15.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.94 1.296 . . . . 0.0 110.883 177.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.64 -28.39 67.19 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.578 1.151 . . . . 0.0 113.457 -166.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -63.27 -51.36 66.47 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 123.68 0.613 . . . . 0.0 110.281 175.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HB2' HG12 ' A' ' 78' ' ' VAL . 4.4 mp0 -68.9 -31.94 71.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.154 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.1 mt -73.17 -18.03 61.31 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -78.34 -35.86 47.02 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.434 0.694 . . . . 0.0 109.596 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.79 2.1 10.95 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.561 0.744 . . . . 0.0 112.499 176.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.625 HD11 HD13 ' A' ' 91' ' ' LEU . 38.8 mt -70.05 140.72 52.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.024 0.529 . . . . 0.0 112.007 172.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.41 -51.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.416 0 O-C-N 124.509 1.131 . . . . 0.0 108.206 170.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.7 p -102.87 149.07 24.87 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.129 0.572 . . . . 0.0 110.679 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 48' ' ' ARG . 4.0 m -67.38 -26.73 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.615 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.52 -45.55 77.11 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.817 . . . . 0.0 110.528 169.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.86 -40.8 85.4 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-N 114.854 -1.067 . . . . 0.0 109.877 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.625 HD13 HD11 ' A' ' 85' ' ' LEU . 47.0 tp -65.87 -39.26 90.53 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.659 0.783 . . . . 0.0 112.425 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CE1' ' HG2' ' A' ' 28' ' ' GLU . 60.4 m-85 -62.06 -36.99 83.32 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.95 -23.13 33.57 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.706 0.802 . . . . 0.0 112.271 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 tt -74.45 -55.37 6.04 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.55 -37.28 74.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.032 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.52 -45.75 84.63 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 123.948 0.78 . . . . 0.0 111.233 173.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -57.85 -48.47 79.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.922 0.889 . . . . 0.0 111.072 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -82.25 -33.83 29.07 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.621 -174.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.08 -42.07 48.49 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.57 -54.07 49.91 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.166 0.587 . . . . 0.0 110.28 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 65.64 156.38 0.09 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.773 1.229 . . . . 0.0 113.304 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.56 -25.63 11.87 Favored Glycine 0 N--CA 1.471 1.012 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.6 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 55.4 m . . . . . 0 CA--C 1.548 0.901 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 174.102 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.801 0.334 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.25 105.82 0.24 Allowed Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 m -82.86 115.17 21.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.724 0.81 . . . . 0.0 110.2 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.2 m -70.16 89.51 0.64 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.419 0.687 . . . . 0.0 109.787 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -86.56 118.1 25.76 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.28 149.85 24.77 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.091 0.956 . . . . 0.0 110.965 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -141.05 73.77 1.43 Allowed 'General case' 0 C--N 1.351 0.646 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -79.89 169.13 18.34 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.688 166.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -133.75 138.93 46.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.086 0.954 . . . . 0.0 109.047 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -74.05 126.48 30.6 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.25 0.62 . . . . 0.0 110.308 -178.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.9 p -72.34 88.7 1.19 Allowed 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 171.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.9 t -111.94 10.87 20.61 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.515 1.126 . . . . 0.0 110.851 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.19 82.54 0.65 Allowed Glycine 0 C--N 1.347 1.176 0 O-C-N 123.162 0.289 . . . . 0.0 112.965 -175.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.4 -83.5 0.22 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 175.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 54.47 -159.52 0.17 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.343 1.057 . . . . 0.0 111.848 174.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 51.69 85.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.053 1.341 . . . . 0.0 112.574 172.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.69 108.89 3.09 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.072 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 28.3 p90 -71.15 121.65 18.7 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.676 1.19 . . . . 0.0 111.354 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -133.96 98.77 4.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.034 0.933 . . . . 0.0 108.879 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 55.34 71.51 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.434 1.094 . . . . 0.0 110.981 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.71 -84.83 0.06 OUTLIER Glycine 0 C--N 1.353 1.497 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.972 -174.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.1 t60 52.86 79.09 0.12 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.725 1.21 . . . . 0.0 110.608 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.2 ptp -125.08 97.85 37.12 Favored Pre-proline 0 N--CA 1.479 1.019 0 CA-C-O 121.133 0.492 . . . . 0.0 111.128 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.25 176.54 8.66 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.492 2.128 . . . . 0.0 110.942 168.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -77.38 -57.54 3.77 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.7 t70 65.87 164.95 0.18 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.878 1.271 . . . . 0.0 111.666 173.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 ttp -122.33 -44.1 2.27 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.461 -0.775 . . . . 0.0 111.01 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.99 -61.93 1.68 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.899 0.88 . . . . 0.0 112.069 -171.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -65.2 -30.92 71.86 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.704 0.802 . . . . 0.0 110.478 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -63.17 -41.1 99.17 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.741 0.817 . . . . 0.0 109.584 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.506 HD21 ' HG ' ' A' ' 91' ' ' LEU . 39.2 tp -66.69 -38.92 87.75 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.184 0.994 . . . . 0.0 110.003 177.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.5 tp -62.23 -38.74 90.38 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.489 1.116 . . . . 0.0 110.777 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.3 m -66.56 -42.37 87.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.114 0.966 . . . . 0.0 110.684 176.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -57.87 -45.88 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.697 0.799 . . . . 0.0 110.861 177.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 83.5 mt -63.04 -37.94 89.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.519 0.728 . . . . 0.0 111.133 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -61.89 -37.98 86.63 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.509 0.724 . . . . 0.0 111.242 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 56.7 t -79.72 -32.91 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.506 0.723 . . . . 0.0 110.539 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.19 -14.07 58.74 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.757 0.823 . . . . 0.0 111.914 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.463 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 18.4 m -112.24 -38.86 4.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.256 0.622 . . . . 0.0 110.847 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.7 -30.28 10.58 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.008 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.62 137.84 88.33 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.289 0.635 . . . . 0.0 110.364 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.71 161.44 10.06 Favored 'Trans proline' 0 C--N 1.379 2.138 0 C-N-CA 123.46 2.773 . . . . 0.0 113.802 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.92 -29.42 70.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.713 0.805 . . . . 0.0 111.214 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.53 -18.22 64.32 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 111.609 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -89.49 -20.08 24.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.415 0.686 . . . . 0.0 111.175 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.4 mt -102.43 105.04 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.975 0.51 . . . . 0.0 110.892 -174.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.9 p -95.27 -178.02 4.31 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 165.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.73 ' HA ' ' HB ' ' A' ' 88' ' ' VAL . 11.0 ptp180 -84.73 -11.53 55.64 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.596 -0.69 . . . . 0.0 111.25 175.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.99 13.45 28.91 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.607 0.763 . . . . 0.0 110.456 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -85.02 18.34 2.54 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.259 0.624 . . . . 0.0 112.577 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.4 ' O ' HD12 ' A' ' 55' ' ' LEU . 3.8 mmm180 68.12 167.01 0.25 Allowed 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.145 175.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.507 ' HG3' ' HB3' ' A' ' 85' ' ' LEU . 87.9 mmm -121.53 94.47 4.33 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 170.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -137.92 -65.66 0.51 Allowed 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -83.43 -35.14 25.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.245 176.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 70.1 mt -69.69 -44.11 71.1 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.257 -172.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.92 94.95 0.08 Allowed 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.512 1.133 . . . . 0.0 109.68 169.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -163.64 -37.66 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.088 0.955 . . . . 0.0 108.496 175.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -53.98 139.53 34.05 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.046 0.841 . . . . 0.0 110.041 168.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -47.73 -47.29 30.24 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.103 1.361 . . . . 0.0 113.183 -173.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.3 mt -80.36 -25.83 38.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.872 -174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.1 t -77.29 -29.24 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 123.174 0.296 . . . . 0.0 110.207 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.4 t -70.14 -44.68 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.619 0.768 . . . . 0.0 109.897 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.8 p -67.76 -33.58 75.13 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.548 0.53 . . . . 0.0 110.777 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.63 -47.65 74.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.758 0.823 . . . . 0.0 110.422 175.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.8 tp -68.89 -40.48 79.18 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 -174.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 66.5 m -62.6 -48.38 79.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.978 0.511 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.3 tp -57.05 -36.23 70.26 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.865 0.728 . . . . 0.0 110.483 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.0 tppt? -68.61 -52.93 26.11 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.368 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 83.6 mt -52.01 -44.11 63.99 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.11 0.964 . . . . 0.0 111.532 -175.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -61.06 -36.93 80.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.472 1.109 . . . . 0.0 111.92 -174.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -97.92 -64.87 1.0 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.964 0.506 . . . . 0.0 110.905 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.86 -40.62 63.58 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.704 1.602 . . . . 0.0 113.24 -173.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -120.57 -14.79 8.59 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -171.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.85 16.42 79.34 Favored Glycine 0 CA--C 1.534 1.249 0 N-CA-C 113.862 0.305 . . . . 0.0 113.862 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.612 HG21 HG13 ' A' ' 95' ' ' VAL . 59.1 t -93.87 136.16 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 123.86 0.864 . . . . 0.0 108.854 176.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -67.37 156.99 35.13 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 122.736 0.415 . . . . 0.0 111.4 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.16 88.28 0.15 Allowed Glycine 0 C--N 1.357 1.699 0 O-C-N 123.41 0.444 . . . . 0.0 112.994 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.6 m -94.14 47.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.312 1.045 . . . . 0.0 111.226 -174.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -48.12 -39.85 21.76 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.409 1.484 . . . . 0.0 113.963 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.99 -52.45 65.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.335 1.054 . . . . 0.0 110.085 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.11 -25.71 61.85 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -176.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.23 -31.09 70.34 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.856 0.463 . . . . 0.0 110.85 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.53 -26.45 45.75 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.776 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -90.21 12.97 16.42 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.908 0.483 . . . . 0.0 112.22 176.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.528 HD21 HD22 ' A' ' 94' ' ' LEU . 94.1 mt -80.09 148.42 31.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.665 0.386 . . . . 0.0 110.63 172.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -115.47 -55.88 2.4 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.587 0.755 . . . . 0.0 109.858 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.3 p -119.44 163.61 16.99 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.896 0.879 . . . . 0.0 109.637 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 48' ' ' ARG . 11.0 t -69.63 -23.25 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 30.6 t70 -57.12 -48.45 78.62 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.372 0.669 . . . . 0.0 109.739 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -55.75 -39.21 70.85 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.085 0.866 . . . . 0.0 111.265 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.506 ' HG ' HD21 ' A' ' 31' ' ' LEU . 44.4 tp -63.42 -48.45 77.74 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 123.707 0.63 . . . . 0.0 111.601 176.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -60.46 -34.75 74.46 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.363 0.665 . . . . 0.0 110.932 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 16.7 mm100 -75.91 -36.68 59.34 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.608 0.567 . . . . 0.0 110.501 177.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD22 HD21 ' A' ' 85' ' ' LEU . 26.7 tp -61.2 -53.47 56.46 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.448 0.699 . . . . 0.0 109.748 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.612 HG13 HG21 ' A' ' 75' ' ' VAL . 84.7 t -61.8 -34.73 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.659 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.43 -62.53 1.78 Allowed 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.607 0.763 . . . . 0.0 111.476 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -38.66 90.42 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.881 0.473 . . . . 0.0 111.66 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -74.44 -25.27 59.32 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.308 0.643 . . . . 0.0 112.713 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -88.28 -35.25 17.35 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.549 0.34 . . . . 0.0 110.319 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.93 -31.17 66.08 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.447 0.699 . . . . 0.0 110.77 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 55.61 34.81 23.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.885 1.274 . . . . 0.0 111.7 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -63.69 -18.29 61.43 Favored Glycine 0 C--N 1.355 1.613 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.966 -175.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.248 0.999 0 C-N-CA 124.066 0.946 . . . . 0.0 108.75 175.679 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.69 47.47 0.02 OUTLIER Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.831 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.8 p -72.77 117.3 14.31 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 122.937 0.495 . . . . 0.0 110.013 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.7 m -139.76 128.47 23.18 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.679 0.792 . . . . 0.0 109.379 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -143.85 121.86 12.09 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -126.7 163.95 22.38 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.285 0.634 . . . . 0.0 109.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -130.91 26.14 4.96 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.159 0.983 . . . . 0.0 110.362 -173.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -74.19 80.12 1.79 Allowed 'General case' 0 CA--C 1.556 1.194 0 CA-C-O 122.114 0.959 . . . . 0.0 111.376 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -156.19 -34.3 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.22 1.408 . . . . 0.0 108.759 176.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -103.17 113.73 27.44 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -139.06 33.48 2.14 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.805 0.842 . . . . 0.0 109.074 -179.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.2 m -60.91 118.63 6.93 Favored 'General case' 0 C--N 1.354 0.773 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.119 -176.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -165.75 167.34 39.05 Favored Glycine 0 C--N 1.336 0.543 0 O-C-N 123.771 0.669 . . . . 0.0 111.916 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.4 ttm105 -86.66 125.07 33.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.933 0.893 . . . . 0.0 110.787 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.45 133.09 35.2 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 164.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -79.36 75.92 5.94 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.284 0.564 . . . . 0.0 110.753 -172.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -96.02 103.03 14.9 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.903 0.881 . . . . 0.0 108.696 174.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -80.81 -70.64 0.51 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 63.84 141.4 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.452 1.501 . . . . 0.0 111.964 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.1 tm0? -139.64 116.63 11.02 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 162.35 176.97 34.98 Favored Glycine 0 C--N 1.342 0.893 0 O-C-N 123.857 0.723 . . . . 0.0 112.008 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -124.24 -18.5 5.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.699 0.8 . . . . 0.0 111.069 -178.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 69.47 169.77 0.11 Allowed Pre-proline 0 N--CA 1.493 1.682 0 C-N-CA 124.354 1.062 . . . . 0.0 108.902 -160.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 25' ' ' ASN . 36.1 Cg_exo -59.37 -91.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 121.713 1.609 . . . . 0.0 112.861 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.409 ' H ' ' HB2' ' A' ' 24' ' ' PRO . 4.4 p-10 177.09 24.53 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.611 1.164 . . . . 0.0 108.807 -176.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -80.07 -61.49 1.97 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.756 1.222 . . . . 0.0 112.156 -167.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.532 ' SD ' HD13 ' A' ' 31' ' ' LEU . 19.4 tmm? -172.54 -39.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.11 0.964 . . . . 0.0 108.839 -167.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -59.1 -49.83 76.39 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.066 0.546 . . . . 0.0 110.831 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -49.72 -40.53 40.95 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.345 1.058 . . . . 0.0 111.536 171.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.12 -38.47 69.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.613 0.765 . . . . 0.0 111.287 -173.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.532 HD13 ' SD ' ' A' ' 27' ' ' MET . 11.1 mp -69.75 -33.29 72.23 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 117.973 0.351 . . . . 0.0 110.758 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.34 -33.9 77.06 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.428 0.455 . . . . 0.0 110.41 172.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.9 m -71.88 -39.82 69.36 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.214 0.605 . . . . 0.0 110.337 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.0 t -58.51 -49.63 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.797 0.839 . . . . 0.0 110.042 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.25 -28.3 66.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.628 0.771 . . . . 0.0 111.556 177.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 29.9 t -66.1 -38.17 87.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.842 0.457 . . . . 0.0 111.015 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.2 t -87.17 -30.12 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.09 47.82 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.233 0.613 . . . . 0.0 112.032 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.2 m -108.62 -26.0 10.6 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.184 0.594 . . . . 0.0 111.495 -175.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.49 -27.48 19.35 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-O 119.997 -0.335 . . . . 0.0 112.83 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' SER . 36.0 m -73.0 141.11 81.21 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 123.16 0.584 . . . . 0.0 110.214 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.42 165.63 29.92 Favored 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 122.354 2.036 . . . . 0.0 112.163 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -60.86 -23.31 65.05 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.907 0.883 . . . . 0.0 111.999 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.41 -29.18 65.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.197 0.999 . . . . 0.0 110.887 -176.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -79.66 -11.08 59.87 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.732 0.813 . . . . 0.0 111.343 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.0 mt -110.24 146.78 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.852 0.861 . . . . 0.0 109.743 -174.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.8 p -145.27 157.21 44.11 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 171.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -66.08 -22.51 66.41 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 117.759 0.254 . . . . 0.0 111.145 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -112.07 92.63 4.1 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 171.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -159.34 160.99 35.69 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.317 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmm180 -84.66 129.65 34.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.875 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.418 ' HE3' ' HA ' ' A' ' 88' ' ' VAL . 28.0 mtt -88.58 56.12 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.069 0.948 . . . . 0.0 110.116 174.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.432 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 21.4 mm-40 -71.13 -16.85 62.58 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.827 175.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.92 -30.27 0.53 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.267 1.027 . . . . 0.0 110.737 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -73.79 -10.05 59.27 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.95 33.03 0.15 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.793 0.837 . . . . 0.0 109.311 172.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -99.15 -62.1 1.28 Allowed 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.053 -171.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.501 ' HB3' HG23 ' A' ' 61' ' ' VAL . 34.5 t70 -66.8 152.62 45.19 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.991 0.516 . . . . 0.0 111.704 -176.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 m -52.8 -42.71 65.34 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.107 1.363 . . . . 0.0 112.656 -178.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -67.03 -42.23 85.23 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.834 0.709 . . . . 0.0 110.493 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.501 HG23 ' HB3' ' A' ' 58' ' ' ASP . 21.7 t -64.46 -41.86 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 O-C-N 123.693 0.621 . . . . 0.0 110.482 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.8 t -66.53 -38.95 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.977 0.911 . . . . 0.0 110.503 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.6 t -66.81 -42.38 86.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.726 0.81 . . . . 0.0 110.938 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 41.0 mt-10 -74.48 -33.06 62.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.836 0.854 . . . . 0.0 110.588 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.7 tp -65.19 -41.16 94.82 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.018 0.927 . . . . 0.0 109.734 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.8 t -62.73 -46.42 88.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.118 0.967 . . . . 0.0 110.88 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.79 -30.69 70.95 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.068 -176.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 44.8 mmtm -71.11 -59.71 2.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.783 0.433 . . . . 0.0 110.776 175.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 91' ' ' LEU . 95.9 mt -60.71 -27.6 68.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.526 0.73 . . . . 0.0 112.242 -174.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.14 -56.13 18.74 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.657 1.183 . . . . 0.0 109.683 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -81.47 -40.56 23.09 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.098 -176.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.29 -45.87 53.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.938 0.895 . . . . 0.0 112.152 -166.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.26 -8.74 7.01 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.025 -176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.53 3.64 90.1 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 120.167 -0.24 . . . . 0.0 113.022 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.547 HG12 HG21 ' A' ' 78' ' ' VAL . 59.2 t -81.89 83.8 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.928 0.891 . . . . 0.0 109.239 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -130.53 159.41 37.19 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.766 1.226 . . . . 0.0 109.009 178.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.51 24.73 62.33 Favored Glycine 0 C--N 1.337 0.638 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -167.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.547 HG21 HG12 ' A' ' 75' ' ' VAL . 28.0 m -122.4 17.47 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.299 1.44 . . . . 0.0 109.903 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 82' ' ' LEU . 25.6 t70 -63.96 -31.76 73.06 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.704 0.802 . . . . 0.0 112.063 -170.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -60.91 -48.78 80.24 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.023 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.402 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.1 mt-10 -63.57 -37.18 86.34 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.495 0.718 . . . . 0.0 111.429 178.386 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 79' ' ' ASP . 92.1 mt -62.4 -38.11 88.4 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.002 0.921 . . . . 0.0 111.392 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.28 -24.5 59.27 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.451 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.23 -2.79 58.63 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.699 0.799 . . . . 0.0 111.945 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 70.9 mt -77.74 115.33 17.41 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.041 0.448 . . . . 0.0 110.403 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -116.45 -1.71 12.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.369 1.068 . . . . 0.0 109.945 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 p -143.24 137.81 29.18 Favored 'General case' 0 C--O 1.257 1.484 0 C-N-CA 124.732 1.213 . . . . 0.0 109.608 -176.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.418 ' HA ' ' HE3' ' A' ' 52' ' ' MET . 53.4 t -64.86 -35.38 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 -176.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 34.0 t70 -61.93 -35.25 77.86 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.78 0.432 . . . . 0.0 111.001 179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -68.48 -28.11 66.74 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.811 0.444 . . . . 0.0 111.713 176.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 69' ' ' LEU . 65.7 tp -61.99 -41.0 97.54 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 123.196 0.31 . . . . 0.0 110.616 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.407 ' HD1' ' O ' ' A' ' 88' ' ' VAL . 25.7 m-85 -66.29 -39.47 89.38 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.42 0.688 . . . . 0.0 111.751 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 61.7 mm-40 -69.55 -35.43 75.4 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 78' ' ' VAL . 43.2 tp -58.33 -55.43 35.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.011 0.924 . . . . 0.0 110.456 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.38 -46.46 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.785 -177.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.17 -54.63 43.61 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.658 0.783 . . . . 0.0 112.032 -176.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.23 -43.16 82.67 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.393 0.677 . . . . 0.0 111.506 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -75.83 -18.23 59.54 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.349 0.406 . . . . 0.0 112.057 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -86.34 -28.56 23.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.53 -43.7 63.17 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.352 0.661 . . . . 0.0 110.565 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 56.44 42.63 27.25 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.769 1.228 . . . . 0.0 111.47 178.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -63.68 -36.75 93.74 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.056 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 C--O 1.25 1.092 0 C-N-CA 123.879 0.872 . . . . 0.0 109.458 175.355 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.97 49.69 Favored Glycine 0 C--N 1.34 0.776 0 O-C-N 123.682 0.614 . . . . 0.0 113.319 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 p -172.34 170.61 4.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.678 1.191 . . . . 0.0 109.938 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.6 m -72.38 -57.15 4.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.5 t60 56.01 75.59 0.33 Allowed 'General case' 0 C--N 1.36 1.047 0 C-N-CA 124.974 1.309 . . . . 0.0 109.808 -174.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -87.57 146.32 25.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.596 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -72.53 -51.01 21.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.047 0.539 . . . . 0.0 111.298 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -155.03 134.05 12.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.931 0.492 . . . . 0.0 110.488 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -81.68 148.14 29.16 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -73.15 148.32 43.98 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.444 0.298 . . . . 0.0 110.398 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -66.52 -50.23 63.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.187 0.595 . . . . 0.0 110.001 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.1 m -152.47 -67.32 0.16 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.282 1.033 . . . . 0.0 109.845 174.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 74.32 60.57 3.48 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 123.307 0.379 . . . . 0.0 112.356 -175.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -75.36 -37.09 60.83 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.797 0.839 . . . . 0.0 110.947 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -70.48 136.46 49.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.8 0.44 . . . . 0.0 110.126 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -71.25 96.97 1.48 Allowed 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.981 0.912 . . . . 0.0 108.897 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.4 mp 63.41 -153.93 0.33 Allowed 'General case' 0 CA--C 1.557 1.24 0 O-C-N 124.217 0.948 . . . . 0.0 109.215 -172.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -155.0 -59.21 0.11 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 171.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -79.72 106.58 11.85 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.182 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -165.97 110.11 0.81 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 155.22 -34.79 0.66 Allowed Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.657 -0.577 . . . . 0.0 111.657 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.63 66.7 9.6 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.805 0.812 . . . . 0.0 108.838 177.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -169.24 121.61 0.65 Allowed Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.289 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.24 98.33 0.38 Allowed 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.683 2.255 . . . . 0.0 110.876 172.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -65.02 114.82 4.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.829 0.852 . . . . 0.0 110.901 -177.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -70.45 91.98 0.79 Allowed 'General case' 0 C--O 1.242 0.693 0 C-N-CA 124.014 0.926 . . . . 0.0 111.115 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.3 ptm -64.12 -22.56 66.98 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.957 173.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.83 -50.33 67.08 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 124.259 1.023 . . . . 0.0 110.826 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -69.17 -31.99 71.01 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 123.683 0.614 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -65.73 -42.52 90.91 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.692 176.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.4 tt -70.68 -32.68 70.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.86 1.264 . . . . 0.0 109.173 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.7 tp -67.75 -36.72 81.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.162 0.985 . . . . 0.0 109.909 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.1 m -69.99 -36.29 75.05 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.15 0.98 . . . . 0.0 110.766 176.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.53 -46.78 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.384 0.674 . . . . 0.0 110.059 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.407 HD21 HD21 ' A' ' 91' ' ' LEU . 98.4 mt -68.33 -28.56 67.26 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.109 0.964 . . . . 0.0 111.606 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -65.4 -53.71 39.23 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.202 0.601 . . . . 0.0 110.249 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.85 -37.03 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.784 -178.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.83 -50.53 66.31 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.107 0.563 . . . . 0.0 111.33 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m -79.68 -21.0 45.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.277 0.631 . . . . 0.0 111.142 -178.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.35 4.77 83.29 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-O 119.769 -0.462 . . . . 0.0 113.6 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.8 m -105.86 149.39 37.95 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.357 1.063 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.523 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 29.7 Cg_endo -61.75 160.16 30.01 Favored 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 122.176 1.917 . . . . 0.0 112.389 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.18 -20.88 65.81 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.582 0.753 . . . . 0.0 111.649 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -68.86 -20.2 64.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.025 0.93 . . . . 0.0 112.109 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.523 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 18.0 mm-40 -82.24 -29.11 31.48 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.21 0.604 . . . . 0.0 110.527 174.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 HD23 ' A' ' 55' ' ' LEU . 6.2 mt -88.71 90.83 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.54 -172.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.3 t -79.22 -0.64 32.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.562 0.745 . . . . 0.0 111.794 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 mtm180 75.15 -35.78 0.29 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 126.465 1.906 . . . . 0.0 112.067 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -76.97 3.1 12.97 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.25 1.02 . . . . 0.0 111.327 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.7 t -54.17 132.67 43.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.399 1.079 . . . . 0.0 110.825 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -91.99 31.35 1.26 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.773 0.829 . . . . 0.0 111.446 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.753 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 17.0 mmt 62.86 15.94 8.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.147 0.979 . . . . 0.0 112.694 174.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.66 -46.16 89.86 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.475 0.71 . . . . 0.0 112.32 -168.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -124.9 5.45 8.03 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.936 0.894 . . . . 0.0 109.972 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.426 HD23 HG12 ' A' ' 46' ' ' ILE . 3.5 mp -123.65 122.02 37.05 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.277 0.631 . . . . 0.0 110.235 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.612 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 74.2 -28.93 0.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.753 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 50.4 t80 -82.56 -19.45 38.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.539 0.736 . . . . 0.0 112.731 -169.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.86 136.18 57.93 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.703 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.9 m -54.36 -39.66 67.37 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.654 0.782 . . . . 0.0 113.084 -170.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.3 -42.27 93.23 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.39 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 27.2 t -74.99 -23.28 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.402 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.2 t -71.58 -34.03 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 172.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.1 m -69.94 -31.71 69.59 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.467 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -77.33 -29.12 53.35 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.43 0.692 . . . . 0.0 111.224 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -48.05 58.45 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.411 0.685 . . . . 0.0 109.35 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 26.9 p -61.81 -39.0 90.23 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.281 176.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.2 tp -57.62 -52.15 66.58 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.685 0.794 . . . . 0.0 111.325 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -68.78 -61.7 1.7 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.495 -175.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.6 mt -51.69 -35.68 43.65 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.78 0.675 . . . . 0.0 111.89 -176.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 66' ' ' SER . 60.8 ttt180 -55.81 -44.42 77.84 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.004 1.322 . . . . 0.0 112.816 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -100.17 -54.61 2.83 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.191 0.596 . . . . 0.0 111.619 -178.056 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -51.99 -48.7 64.3 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.239 1.416 . . . . 0.0 112.413 -176.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -116.59 -12.2 10.97 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.208 0.603 . . . . 0.0 111.884 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.44 -11.22 59.27 Favored Glycine 0 N--CA 1.473 1.161 0 CA-C-O 120.046 -0.308 . . . . 0.0 113.465 -176.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.672 HG21 HG13 ' A' ' 95' ' ' VAL . 50.6 t -71.7 92.52 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 124.514 1.125 . . . . 0.0 109.989 -174.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -117.66 166.1 12.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.272 0.629 . . . . 0.0 110.936 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.22 65.79 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.575 0.547 . . . . 0.0 113.027 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.408 HG11 HG12 ' A' ' 75' ' ' VAL . 27.3 m -98.8 8.94 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.086 0.955 . . . . 0.0 111.75 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' A' ' 82' ' ' LEU . 6.8 p-10 -58.38 -33.38 69.54 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.622 1.169 . . . . 0.0 111.509 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -58.71 -57.83 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.68 1.192 . . . . 0.0 110.958 175.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG3' HD11 ' A' ' 94' ' ' LEU . 9.6 pt-20 -77.42 -19.66 55.76 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.03 -174.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 79' ' ' ASP . 34.8 mt -64.41 -39.64 94.25 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.046 0.938 . . . . 0.0 110.233 169.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -67.84 -35.65 78.96 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.484 173.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.51 -4.21 47.46 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.481 0.712 . . . . 0.0 112.744 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 91' ' ' LEU . 87.4 mt -74.91 140.69 43.96 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.776 0.43 . . . . 0.0 111.476 177.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.36 -0.1 5.68 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.222 1.009 . . . . 0.0 109.666 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p -155.09 140.03 17.3 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.305 1.042 . . . . 0.0 110.868 -170.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.3 t -75.77 -33.2 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.025 0.93 . . . . 0.0 111.329 -174.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.58 -38.31 87.09 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.155 0.502 . . . . 0.0 110.705 176.095 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.29 -29.48 68.27 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.962 0.905 . . . . 0.0 111.528 174.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.505 ' HB2' HD13 ' A' ' 85' ' ' LEU . 33.7 tp -66.72 -38.72 87.27 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.647 0.379 . . . . 0.0 111.553 171.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -61.39 -48.1 82.8 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 174.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -62.85 -30.02 71.19 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.702 0.801 . . . . 0.0 112.447 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' A' ' 81' ' ' GLU . 7.1 tt -61.27 -58.18 9.31 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.385 1.074 . . . . 0.0 109.206 175.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 HG21 ' A' ' 75' ' ' VAL . 96.4 t -63.92 -40.37 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.966 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.69 -35.78 80.94 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.711 0.804 . . . . 0.0 111.309 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -66.71 -46.6 75.01 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -72.09 -24.31 61.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.715 0.806 . . . . 0.0 111.456 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.3 -34.0 59.07 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.05 -18.91 38.03 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.543 0.737 . . . . 0.0 111.354 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 64.73 9.79 5.5 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 125.291 1.437 . . . . 0.0 112.059 -172.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 60.61 36.2 91.01 Favored Glycine 0 C--N 1.359 1.824 0 C-N-CA 123.212 0.434 . . . . 0.0 113.058 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 123.428 0.691 . . . . 0.0 110.448 -176.568 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.656 0.265 . . . . 0.0 110.666 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.35 173.81 13.47 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.159 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.5 p -161.85 130.42 4.29 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.053 0.941 . . . . 0.0 109.65 177.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.1 m -82.82 93.83 7.53 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.534 0.733 . . . . 0.0 110.217 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -87.31 123.98 32.87 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.063 0.545 . . . . 0.0 109.89 178.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -72.25 127.31 32.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.054 0.541 . . . . 0.0 109.843 174.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -140.16 147.06 39.6 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -125.03 158.39 33.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.185 0.594 . . . . 0.0 110.535 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -143.21 110.97 5.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.433 1.093 . . . . 0.0 108.633 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -75.5 103.59 5.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.1 p -126.86 147.22 50.06 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.893 0.877 . . . . 0.0 110.559 -177.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -81.18 119.32 23.45 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.5 0.72 . . . . 0.0 109.261 176.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -82.52 59.43 4.93 Favored Glycine 0 C--N 1.349 1.305 0 C-N-CA 122.979 0.323 . . . . 0.0 112.816 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -101.14 12.71 37.09 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 124.071 0.948 . . . . 0.0 110.031 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -73.44 86.22 1.53 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.998 0.919 . . . . 0.0 110.077 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.4 t30 64.98 166.62 0.17 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.808 1.243 . . . . 0.0 111.084 -177.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -151.06 117.27 5.62 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -79.68 89.76 5.17 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -63.49 -55.16 26.29 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.177 0.591 . . . . 0.0 109.914 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -150.97 175.88 11.65 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -54.55 -40.89 71.6 Favored Glycine 0 C--N 1.359 1.855 0 O-C-N 123.208 0.318 . . . . 0.0 113.012 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -81.28 109.44 15.79 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 171.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -106.92 152.38 40.92 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.482 1.113 . . . . 0.0 109.488 176.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -54.07 155.33 15.44 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.087 2.525 . . . . 0.0 113.103 174.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 m120 66.43 101.08 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.003 1.321 . . . . 0.0 109.341 -170.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.59 172.0 14.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.009 0.923 . . . . 0.0 110.482 -177.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -30.48 68.86 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.292 0.637 . . . . 0.0 110.071 174.073 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.42 -46.35 90.31 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 124.11 0.964 . . . . 0.0 111.423 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.13 -37.32 87.06 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.807 0.692 . . . . 0.0 110.469 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.471 ' O ' HG23 ' A' ' 34' ' ' VAL . 27.5 m170 -72.89 -30.36 63.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.455 0.702 . . . . 0.0 110.734 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.48 -34.65 65.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.151 0.98 . . . . 0.0 108.848 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.15 -31.81 70.73 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.579 175.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.5 m -70.13 -38.84 75.63 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.004 0.922 . . . . 0.0 110.243 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 30' ' ' HIS . 67.5 t -57.87 -50.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.207 0.603 . . . . 0.0 109.713 174.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 81.9 mt -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.005 0.922 . . . . 0.0 112.078 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.4 t -64.26 -48.58 75.2 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.132 0.573 . . . . 0.0 110.661 178.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -77.97 -23.18 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.862 0.865 . . . . 0.0 110.841 -177.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.52 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -79.38 -42.89 24.55 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.435 0.694 . . . . 0.0 111.014 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.3 p -80.52 -53.58 6.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.391 0.676 . . . . 0.0 110.593 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.3 -23.57 6.79 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.853 -174.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.2 m -87.14 149.83 48.26 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 123.582 0.753 . . . . 0.0 109.764 176.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.473 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 69.6 Cg_endo -71.22 165.88 31.01 Favored 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 122.394 2.063 . . . . 0.0 112.164 179.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.15 -26.97 66.7 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.714 0.806 . . . . 0.0 111.406 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.04 -33.33 75.21 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.643 0.777 . . . . 0.0 111.739 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 13.2 mm-40 -84.91 -18.86 33.36 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.241 0.616 . . . . 0.0 111.734 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.9 mt -97.6 154.19 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.78 0.832 . . . . 0.0 109.66 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 t -155.68 177.13 11.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -59.07 -40.99 86.91 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -79.99 81.34 6.27 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.458 -1.246 . . . . 0.0 108.497 176.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.1 t -162.1 113.95 1.68 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-N 114.278 -1.328 . . . . 0.0 108.388 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -68.37 108.66 3.32 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.54 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 50.6 ttm -73.47 76.55 1.43 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.206 1.402 . . . . 0.0 110.461 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -123.72 16.32 9.48 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.974 0.909 . . . . 0.0 109.852 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -157.55 -44.68 0.07 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.456 1.102 . . . . 0.0 109.663 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.409 ' H ' HD12 ' A' ' 55' ' ' LEU . 5.0 mp -69.51 -30.26 68.08 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.927 -170.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -154.84 39.37 0.43 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.238 0.615 . . . . 0.0 110.374 179.451 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -106.83 -30.96 8.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.855 -176.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.53 140.84 58.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.398 0.679 . . . . 0.0 110.738 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -54.14 -43.54 70.63 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.179 0.992 . . . . 0.0 113.464 -173.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 tt -68.36 -39.0 81.95 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.52 HG13 ' HB1' ' A' ' 38' ' ' ALA . 36.4 t -69.34 -32.9 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 122.984 0.514 . . . . 0.0 111.243 -179.152 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.9 -40.47 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.246 0.618 . . . . 0.0 109.816 175.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 33.7 m -64.89 -47.64 77.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.031 176.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.21 -41.18 83.45 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.706 1.202 . . . . 0.0 110.482 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.466 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 40.8 tp -64.66 -50.98 64.94 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.29 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -55.48 -47.58 75.91 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.012 0.925 . . . . 0.0 111.966 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 63' ' ' SER . 87.9 mt -66.39 -35.53 80.57 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.457 0.703 . . . . 0.0 111.27 -178.245 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -73.42 -40.98 63.83 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 123.64 0.587 . . . . 0.0 110.468 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.0 mt -65.9 -36.34 83.12 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.579 0.752 . . . . 0.0 110.2 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 ttp85 -62.46 -51.0 69.23 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.553 1.141 . . . . 0.0 110.966 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -49.37 51.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.466 -174.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -88.15 -53.54 4.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.567 0.747 . . . . 0.0 111.53 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 69' ' ' LEU . 92.8 m-85 -94.59 -13.54 25.86 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.31 0.644 . . . . 0.0 112.155 -171.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.1 5.05 90.02 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 116.915 -0.129 . . . . 0.0 113.106 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.44 HG21 HG13 ' A' ' 95' ' ' VAL . 75.9 t -81.95 111.29 18.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.036 0.934 . . . . 0.0 109.512 -179.081 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.7 p -62.52 171.55 1.93 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.089 0.955 . . . . 0.0 112.293 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.7 92.49 0.01 OUTLIER Glycine 0 C--N 1.358 1.755 0 O-C-N 124.147 0.904 . . . . 0.0 113.353 -177.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 8.9 m -104.39 37.61 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.371 1.068 . . . . 0.0 110.663 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.55 -41.31 66.33 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.429 1.092 . . . . 0.0 112.29 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -62.93 -44.7 95.35 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.77 0.828 . . . . 0.0 110.609 176.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 25.7 mm-40 -64.92 -31.88 73.33 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.955 178.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 76.0 mt -71.73 -36.72 70.56 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.168 0.587 . . . . 0.0 111.731 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -75.83 -23.2 55.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 110.661 -0.126 . . . . 0.0 110.661 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 81' ' ' GLU . 89.6 mt -68.55 -19.55 64.5 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.3 0.64 . . . . 0.0 111.882 171.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 29.3 mt -82.6 150.66 26.74 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.956 0.503 . . . . 0.0 110.111 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -136.12 -6.1 2.09 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.044 0.938 . . . . 0.0 109.594 175.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.2 m -141.64 154.32 45.3 Favored 'General case' 0 C--O 1.246 0.897 0 C-N-CA 123.027 0.531 . . . . 0.0 110.277 -174.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.04 -32.12 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 123.727 0.811 . . . . 0.0 111.42 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.67 -49.44 67.98 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.074 0.55 . . . . 0.0 110.72 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.01 -37.74 83.6 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.295 -176.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.5 tp -67.29 -47.87 69.33 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.358 0.412 . . . . 0.0 111.848 176.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -59.59 -43.84 93.57 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.556 0.742 . . . . 0.0 111.778 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.7 -31.21 57.08 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.14 0.275 . . . . 0.0 111.479 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.15 -51.23 68.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.984 0.513 . . . . 0.0 110.403 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.44 HG13 HG21 ' A' ' 75' ' ' VAL . 81.1 t -65.47 -42.02 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.847 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -63.65 -45.78 88.6 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 123.672 0.607 . . . . 0.0 111.373 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -73.82 -28.23 61.51 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.212 0.605 . . . . 0.0 111.49 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -81.33 -19.97 41.68 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.681 0.392 . . . . 0.0 110.789 175.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -81.78 -30.63 32.24 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 174.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.5 -30.56 29.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.812 0.845 . . . . 0.0 110.668 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -136.02 89.36 2.48 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.07 0.948 . . . . 0.0 108.798 178.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.02 77.71 1.3 Allowed Glycine 0 C--N 1.352 1.459 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.338 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 CA--C 1.559 1.301 0 C-N-CA 125.24 1.416 . . . . 0.0 110.697 -177.585 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.6 ttt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.31 -41.39 88.91 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 124.51 1.131 . . . . 0.0 111.539 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.68 -45.29 93.47 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.139 0.576 . . . . 0.0 110.721 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -70.3 -33.48 71.6 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.725 0.641 . . . . 0.0 110.696 -175.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.03 -36.31 61.9 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.899 0.88 . . . . 0.0 108.716 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.62 -32.74 74.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.283 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.522 ' HA ' ' HE3' ' A' ' 43' ' ' LYS . 77.9 m -72.57 -38.25 67.97 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.866 0.866 . . . . 0.0 110.627 176.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.29 -45.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.393 0.677 . . . . 0.0 110.127 172.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 71.6 mt -68.82 -37.15 79.01 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.093 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.5 t -67.98 -29.36 68.37 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.375 0.67 . . . . 0.0 111.448 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.4 t -85.23 -43.11 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 123.439 0.696 . . . . 0.0 110.272 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.9 -43.72 87.34 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.534 0.734 . . . . 0.0 111.222 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 13.6 m -81.41 -30.44 33.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.849 0.859 . . . . 0.0 110.169 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.07 -11.29 65.48 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.397 -0.365 . . . . 0.0 113.331 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 33.4 m -91.15 145.16 31.05 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 123.842 0.857 . . . . 0.0 110.61 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -54.88 169.91 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.852 3.034 . . . . 0.0 115.432 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 33' ' ' THR . 44.5 mmtm -60.25 -34.92 74.37 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.115 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.85 -30.95 71.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.314 0.646 . . . . 0.0 111.571 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.55 -4.29 55.6 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mt -127.34 133.29 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.278 0.631 . . . . 0.0 109.507 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.6 t -135.51 167.83 20.36 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.586 0.754 . . . . 0.0 109.44 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -64.38 -55.68 19.45 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.75 89.82 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -170.31 154.26 4.76 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.197 -1.365 . . . . 0.0 108.457 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -94.25 153.34 18.09 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 123.79 0.836 . . . . 0.0 109.472 177.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.687 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 20.0 mmt -73.59 97.17 2.57 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.87 -121.61 0.26 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.374 1.069 . . . . 0.0 108.514 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -85.25 54.46 3.11 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 122.717 1.246 . . . . 0.0 109.25 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.4 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 87.2 mt -127.79 -46.41 1.42 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.778 -176.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.71 21.7 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.426 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.687 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 49.0 t80 -122.58 75.85 1.29 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 121.965 0.888 . . . . 0.0 110.023 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.5 t70 179.55 135.74 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 113.506 -1.679 . . . . 0.0 107.16 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.3 p -52.03 -39.21 59.18 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.893 0.877 . . . . 0.0 113.118 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -68.09 -47.86 67.09 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.764 0.426 . . . . 0.0 110.677 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.47 -28.18 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 -176.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.9 t -74.75 -38.27 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.753 0.821 . . . . 0.0 109.86 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -68.07 -35.28 77.95 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.918 0.487 . . . . 0.0 110.525 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 10.5 tp10 -70.84 -42.92 69.53 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.388 0.675 . . . . 0.0 109.922 176.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 56' ' ' ALA . 56.0 tp -61.29 -48.43 81.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.305 1.042 . . . . 0.0 110.502 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 32.6 t -57.96 -47.64 82.33 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.134 0.974 . . . . 0.0 109.593 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 45.0 tp -53.29 -40.61 64.84 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.15 0.98 . . . . 0.0 111.22 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 71.9 mmtt -65.81 -55.11 18.85 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.566 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.454 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 97.7 mt -56.68 -32.14 65.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.082 0.953 . . . . 0.0 112.588 -173.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 66' ' ' SER . 45.7 mtm180 -59.75 -37.06 77.94 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.493 0.717 . . . . 0.0 111.044 178.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -93.91 -49.22 5.91 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.863 0.865 . . . . 0.0 111.239 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.59 -40.66 69.75 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.768 0.827 . . . . 0.0 111.83 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -125.5 -6.11 7.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.128 0.571 . . . . 0.0 111.909 -175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 75.78 3.6 73.96 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 113.609 0.204 . . . . 0.0 113.609 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.649 HG21 HG13 ' A' ' 95' ' ' VAL . 75.1 t -77.91 98.81 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.991 0.916 . . . . 0.0 109.679 -176.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 25.3 m -123.45 149.69 44.77 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.976 0.911 . . . . 0.0 110.168 -172.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.58 15.25 80.62 Favored Glycine 0 C--N 1.354 1.552 0 O-C-N 123.436 0.46 . . . . 0.0 113.827 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 15.9 m -92.05 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.166 0.986 . . . . 0.0 112.225 -173.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -54.42 -45.62 73.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.123 0.969 . . . . 0.0 111.938 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -65.5 -38.42 89.66 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 124.161 0.913 . . . . 0.0 110.982 -178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.472 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 5.1 mp0 -65.85 -40.38 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.248 1.019 . . . . 0.0 110.947 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.432 ' HA ' ' HG ' ' A' ' 85' ' ' LEU . 85.6 mt -76.01 -25.24 55.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 110.784 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.06 -28.34 62.26 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.061 0.944 . . . . 0.0 110.424 173.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -90.95 10.18 27.56 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.319 1.048 . . . . 0.0 112.35 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.613 HD13 ' HE3' ' A' ' 52' ' ' MET . 78.9 mt -79.53 126.99 31.58 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.89 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -126.73 -45.95 1.59 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.412 1.085 . . . . 0.0 108.083 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 35.5 p -115.61 154.86 28.68 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.816 0.817 . . . . 0.0 110.767 172.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.423 HG12 ' HE2' ' A' ' 92' ' ' PHE . 53.0 t -70.74 -36.82 66.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.115 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.71 -37.77 82.79 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.229 0.611 . . . . 0.0 110.56 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.27 -39.06 85.5 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 124.05 0.844 . . . . 0.0 110.854 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.434 HD13 HD11 ' A' ' 85' ' ' LEU . 44.3 tp -62.71 -42.36 99.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 123.401 0.438 . . . . 0.0 111.397 174.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.423 ' HE2' HG12 ' A' ' 88' ' ' VAL . 71.1 m-85 -59.57 -45.3 92.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.987 0.515 . . . . 0.0 110.638 175.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.15 -31.82 70.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.016 0.927 . . . . 0.0 111.445 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tt -70.22 -55.82 8.34 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.789 0.836 . . . . 0.0 109.653 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.649 HG13 HG21 ' A' ' 75' ' ' VAL . 59.6 t -64.49 -29.19 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 O-C-N 124.076 0.86 . . . . 0.0 110.15 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -61.53 -54.17 46.72 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.077 0.951 . . . . 0.0 110.175 173.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -69.41 -27.19 65.07 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.741 0.816 . . . . 0.0 111.308 -178.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -79.23 -32.29 43.88 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.927 0.891 . . . . 0.0 110.22 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -74.23 -41.09 61.91 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.475 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.47 97.29 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.706 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.106 0 C-N-CA 125.367 1.467 . . . . 0.0 112.295 178.355 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 119.411 -0.328 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.485 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 45.3 tt0 -73.16 -64.26 1.01 Allowed 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -171.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.07 -34.02 74.24 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.81 0.844 . . . . 0.0 110.115 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.6 t-160 -63.55 -42.8 98.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.094 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 91' ' ' LEU . 33.6 tp -74.36 -33.07 62.99 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.519 0.512 . . . . 0.0 110.959 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.6 -28.78 69.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.329 0.252 . . . . 0.0 110.874 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.3 m -72.41 -43.77 63.4 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.827 0.451 . . . . 0.0 110.297 172.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.6 t -54.87 -44.49 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.705 0.802 . . . . 0.0 110.567 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.12 -42.51 80.08 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.348 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.9 p -65.79 -34.74 78.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.729 0.299 . . . . 0.0 111.53 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.28 -36.79 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 C-N-CA 123.497 0.719 . . . . 0.0 110.83 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.32 -36.93 45.75 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.873 0.469 . . . . 0.0 112.038 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 m -87.23 -55.16 3.94 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.925 0.89 . . . . 0.0 110.33 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.5 -24.74 7.96 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.738 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.6 m -76.29 131.26 75.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 122.912 0.485 . . . . 0.0 110.041 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.479 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 25.5 Cg_endo -61.27 161.74 22.34 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.683 2.256 . . . . 0.0 112.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -59.39 -26.06 64.81 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 124.874 1.27 . . . . 0.0 112.467 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -68.38 -24.46 64.78 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.942 0.897 . . . . 0.0 111.369 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.479 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 12.9 mm-40 -85.92 -19.1 31.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.684 0.793 . . . . 0.0 110.92 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.3 mt -99.62 133.75 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.601 0.761 . . . . 0.0 110.33 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 t -121.86 168.55 11.73 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.861 0.864 . . . . 0.0 109.136 172.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -73.34 -20.55 60.76 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.926 0.491 . . . . 0.0 111.832 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.97 1.07 30.74 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.801 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.5 t -65.32 152.14 44.52 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.203 0.601 . . . . 0.0 111.942 -171.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -73.87 160.47 31.38 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.616 0.767 . . . . 0.0 110.606 175.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.676 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 17.4 mmt -104.9 26.67 8.92 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.063 0.945 . . . . 0.0 110.805 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.05 -61.65 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.165 0.507 . . . . 0.0 110.468 -170.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -94.07 -16.16 24.08 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.1 mp -85.61 -17.08 37.22 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.184 0.994 . . . . 0.0 112.278 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -156.42 -152.82 0.39 Allowed 'General case' 0 C--O 1.246 0.908 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 62.56 61.79 1.19 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.445 1.098 . . . . 0.0 112.125 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -177.03 137.52 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 113.197 -1.819 . . . . 0.0 106.918 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.7 m -56.47 -35.44 67.94 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.745 0.653 . . . . 0.0 111.752 -175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -81.48 -38.48 26.28 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.958 0.503 . . . . 0.0 110.822 -174.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.36 -39.71 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 121.372 0.606 . . . . 0.0 110.752 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.544 HG13 ' HB2' ' A' ' 82' ' ' LEU . 56.1 t -72.8 -31.3 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.567 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.5 t -69.03 -33.77 74.16 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.688 0.395 . . . . 0.0 110.309 173.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -70.49 -40.4 73.63 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.158 0.983 . . . . 0.0 110.035 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 38.6 tp -74.36 -35.21 63.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.946 0.899 . . . . 0.0 111.246 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.3 p -72.49 -40.78 66.63 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.845 0.458 . . . . 0.0 109.938 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.0 tp -58.3 -38.76 77.7 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 124.181 0.925 . . . . 0.0 110.466 171.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -64.03 -57.97 8.08 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.469 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.413 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 91.2 mt -62.16 -36.27 81.33 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.579 0.752 . . . . 0.0 111.471 -177.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -56.18 -42.73 77.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.827 1.251 . . . . 0.0 110.886 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -86.66 -32.65 20.42 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.261 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -90.42 -55.04 3.74 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.962 0.505 . . . . 0.0 111.786 -165.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -110.73 -1.83 16.5 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.847 0.859 . . . . 0.0 110.813 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.12 7.13 86.71 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.126 0.393 . . . . 0.0 113.245 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 42.4 t -81.92 95.02 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 123.597 0.759 . . . . 0.0 109.68 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.5 m -111.12 155.25 23.13 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.295 1.038 . . . . 0.0 111.322 -171.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.53 80.45 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 116.583 -0.28 . . . . 0.0 113.491 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 30.3 m -93.07 16.1 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.913 0.885 . . . . 0.0 111.551 -176.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -54.87 -52.48 62.69 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.139 0.975 . . . . 0.0 111.042 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -57.29 -42.91 82.6 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 24.1 mm-40 -60.55 -37.21 80.5 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.23 0.612 . . . . 0.0 111.421 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.544 ' HB2' HG13 ' A' ' 62' ' ' VAL . 87.3 mt -66.18 -35.29 80.06 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.956 0.902 . . . . 0.0 111.226 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -58.86 -43.0 90.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.698 172.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.7 -21.04 61.83 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 82.8 mt -76.76 126.78 31.56 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.53 0.332 . . . . 0.0 110.667 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -102.96 -26.75 12.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.525 0.73 . . . . 0.0 111.107 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 37.0 p -131.4 164.19 26.24 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.408 0.623 . . . . 0.0 111.263 -178.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 85.7 t -69.3 -36.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.016 -176.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.13 -29.27 68.14 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.977 0.511 . . . . 0.0 111.54 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HB3' HD22 ' A' ' 85' ' ' LEU . 47.1 mt-10 -66.5 -39.44 88.71 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.608 0.363 . . . . 0.0 110.476 171.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.499 ' HG ' HD21 ' A' ' 31' ' ' LEU . 37.5 tp -62.76 -42.78 99.84 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.983 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.1 m-85 -57.95 -58.24 9.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.436 0.694 . . . . 0.0 111.328 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -64.07 -24.88 67.87 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.443 0.464 . . . . 0.0 111.533 -176.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.6 tp -69.94 -50.04 45.92 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.293 0.371 . . . . 0.0 110.305 175.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 89.6 t -58.58 -44.99 90.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.056 0.542 . . . . 0.0 110.326 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -67.44 -46.74 72.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.83 0.852 . . . . 0.0 111.895 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -63.23 -56.13 19.11 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.495 0.718 . . . . 0.0 110.589 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -65.95 -22.27 66.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.367 1.067 . . . . 0.0 112.0 -175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -68.94 -56.95 6.26 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.266 0.626 . . . . 0.0 110.261 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -88.35 -62.41 1.5 Allowed 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.348 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.618 0 C-N-CA 123.6 0.76 . . . . 0.0 110.027 179.589 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.6 tmm? . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.38 -41.44 89.38 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.612 0.765 . . . . 0.0 111.349 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -74.22 -29.91 61.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.947 1.299 . . . . 0.0 110.814 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.426 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.1 t60 -70.79 -48.72 52.72 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.702 0.801 . . . . 0.0 109.792 -178.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.524 HD23 ' HG ' ' A' ' 91' ' ' LEU . 8.1 mp -62.62 -35.98 81.29 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.265 0.978 . . . . 0.0 110.384 175.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -61.19 -39.5 90.4 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.915 0.886 . . . . 0.0 110.905 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.4 m -70.23 -39.76 74.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.896 0.878 . . . . 0.0 110.977 175.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.513 HG13 ' HG2' ' A' ' 68' ' ' LYS . 64.5 t -59.77 -48.41 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.367 0.667 . . . . 0.0 110.553 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.32 -31.5 71.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.722 0.809 . . . . 0.0 111.256 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 t -61.72 -43.21 99.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.306 0.642 . . . . 0.0 111.356 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.6 t -79.07 -46.03 23.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.036 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.5 -43.27 73.46 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.852 0.861 . . . . 0.0 112.085 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 m -91.8 -15.35 28.38 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.156 0.582 . . . . 0.0 111.617 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.12 21.5 70.51 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 114.239 0.455 . . . . 0.0 114.239 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.47 152.76 42.91 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 124.245 1.018 . . . . 0.0 110.442 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.76 151.92 45.19 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.506 2.137 . . . . 0.0 112.384 165.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.75 -26.41 68.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.756 0.822 . . . . 0.0 111.32 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -75.28 -19.98 59.39 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.138 0.975 . . . . 0.0 111.573 -176.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.59 -36.59 73.64 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.551 0.691 . . . . 0.0 109.487 176.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG23 HG21 ' A' ' 88' ' ' VAL . 47.9 mt -91.18 89.65 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.827 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -94.18 26.49 3.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.715 0.806 . . . . 0.0 110.669 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.16 -48.17 0.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.136 1.774 . . . . 0.0 110.302 -168.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.28 82.35 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.595 0.758 . . . . 0.0 109.683 164.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB2' HG21 ' A' ' 88' ' ' VAL . 48.8 m -160.57 153.76 21.74 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.548 1.139 . . . . 0.0 109.127 -177.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -101.58 135.95 42.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.058 0.943 . . . . 0.0 109.953 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.526 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 71.9 mmm -81.54 6.41 14.96 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.963 0.505 . . . . 0.0 111.644 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.81 -30.95 71.17 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.491 0.716 . . . . 0.0 111.265 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.44 -43.67 6.81 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.401 167.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 62.2 mt -75.97 -11.5 59.97 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.526 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -169.36 13.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -108.3 -20.14 13.24 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 118.477 0.581 . . . . 0.0 112.341 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.428 ' O ' HG23 ' A' ' 62' ' ' VAL . 24.3 t70 -70.68 135.47 48.35 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 m -54.38 -35.84 63.26 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -172.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.45 -41.12 73.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.27 -35.89 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 123.866 0.729 . . . . 0.0 111.286 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 58' ' ' ASP . 62.4 t -64.06 -44.9 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.7 t -69.24 -37.82 78.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.922 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.93 -35.34 64.59 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.788 0.835 . . . . 0.0 110.796 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.15 -41.39 63.98 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.183 0.993 . . . . 0.0 109.527 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.3 t -60.23 -43.57 95.94 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.709 0.803 . . . . 0.0 109.835 173.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.72 -40.47 95.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.801 1.24 . . . . 0.0 110.639 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.513 ' HG2' HG13 ' A' ' 34' ' ' VAL . 6.7 tppt? -72.39 -56.58 5.22 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.246 -171.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.568 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 87.2 mt -57.99 -34.47 70.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.542 0.737 . . . . 0.0 111.261 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG3' ' HB ' ' A' ' 76' ' ' THR . 72.0 ttt180 -59.04 -34.9 72.46 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.07 1.348 . . . . 0.0 112.222 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -94.32 -58.39 2.23 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 122.953 0.501 . . . . 0.0 110.342 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -54.02 -44.43 70.94 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.663 1.185 . . . . 0.0 112.31 -176.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -118.75 -27.22 5.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.25 0.62 . . . . 0.0 112.162 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.8 7.08 64.91 Favored Glycine 0 N--CA 1.471 1.023 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.568 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 99.0 t -75.85 90.36 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.045 0 C-N-CA 124.153 0.981 . . . . 0.0 109.44 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.445 ' HB ' ' HG3' ' A' ' 70' ' ' ARG . 11.4 t -115.2 163.87 15.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.134 0.974 . . . . 0.0 111.069 -174.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 21.71 65.28 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.701 -0.682 . . . . 0.0 113.359 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 20.6 m -97.97 13.64 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.955 0.902 . . . . 0.0 111.646 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -48.85 -51.01 31.94 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.415 1.486 . . . . 0.0 112.373 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.51 -50.53 72.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.963 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.67 -30.34 71.31 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.29 -177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.6 mt -70.47 -36.18 73.73 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.257 0.623 . . . . 0.0 110.244 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -74.59 -23.96 58.82 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.135 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.79 -13.21 59.93 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.985 0.514 . . . . 0.0 111.752 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 80.3 mt -70.74 158.76 35.72 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.715 0.406 . . . . 0.0 110.734 176.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -136.57 -42.53 0.61 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.05 0.54 . . . . 0.0 110.103 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.422 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 74.9 p -115.71 159.44 21.39 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.315 0.646 . . . . 0.0 111.084 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.459 HG21 HG23 ' A' ' 46' ' ' ILE . 69.0 t -59.21 -36.69 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.137 177.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.405 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 8.0 m-20 -58.52 -35.71 72.7 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.458 176.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.422 ' HG2' ' OG1' ' A' ' 87' ' ' THR . 37.0 mm-40 -70.52 -37.3 74.09 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.251 0.621 . . . . 0.0 111.743 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.524 ' HG ' HD23 ' A' ' 31' ' ' LEU . 65.7 tp -61.88 -42.53 99.18 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 121.149 0.5 . . . . 0.0 110.607 173.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -63.06 -38.19 90.19 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.436 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 86.8 mm-40 -64.98 -48.27 74.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.913 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.4 tt -53.15 -61.06 2.54 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.532 1.133 . . . . 0.0 110.161 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.473 HG11 HD11 ' A' ' 31' ' ' LEU . 43.7 t -68.63 -31.62 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.236 -173.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.659 ' HG3' HH21 ' A' ' 99' ' ' ARG . 40.3 tt0 -61.05 -45.17 95.87 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.24 0.616 . . . . 0.0 111.086 174.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 74.1 mmtt -67.98 -46.26 71.85 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.869 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -70.06 -24.63 63.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.879 0.471 . . . . 0.0 111.551 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.659 HH21 ' HG3' ' A' ' 96' ' ' GLU . 18.5 ttp180 -66.84 -44.49 80.94 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.856 0.862 . . . . 0.0 109.853 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -89.54 -0.41 57.49 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.61 0.764 . . . . 0.0 111.94 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.032 0 C-N-CA 125.297 1.439 . . . . 0.0 111.412 -179.471 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 120.789 0.328 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.418 ' HA ' HD23 ' A' ' 31' ' ' LEU . 39.1 mt-10 -65.52 -32.67 74.39 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.141 0.976 . . . . 0.0 111.143 -175.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.03 -47.44 71.57 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 124.398 1.061 . . . . 0.0 110.793 172.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 34' ' ' VAL . 7.7 m-70 -72.77 -26.65 61.62 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.437 -175.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.429 HD11 HG21 ' A' ' 95' ' ' VAL . 3.5 mm? -60.79 -45.52 94.09 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.731 0.696 . . . . 0.0 109.314 168.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 5.9 mp -66.11 -36.31 82.83 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.478 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -68.25 -42.31 79.84 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.576 0.75 . . . . 0.0 110.682 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.545 HG13 ' HD2' ' A' ' 68' ' ' LYS . 61.3 t -61.13 -49.83 83.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.857 0.463 . . . . 0.0 110.505 178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 90.8 mt -66.74 -39.17 87.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.928 0.767 . . . . 0.0 112.291 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.9 p -65.52 -45.2 84.44 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.154 0.582 . . . . 0.0 111.59 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.0 t -71.13 -30.49 41.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 114.68 -1.145 . . . . 0.0 110.3 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.62 -37.24 62.87 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.061 0.544 . . . . 0.0 112.203 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.494 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 80.7 p -95.01 -60.95 1.57 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.183 0.593 . . . . 0.0 110.993 -173.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.5 -30.95 2.27 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.003 -177.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -72.12 141.3 83.68 Favored Pre-proline 0 C--N 1.356 0.854 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.899 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.552 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 19.3 Cg_endo -59.47 152.59 60.42 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.457 2.105 . . . . 0.0 112.307 176.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.471 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 13.7 ptmm? -60.78 -20.3 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.426 1.09 . . . . 0.0 112.316 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.63 -35.64 80.67 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.839 0.855 . . . . 0.0 111.32 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.552 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 20.3 mm-40 -75.94 -11.97 60.06 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.684 0.794 . . . . 0.0 111.942 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.447 ' HB ' ' HG ' ' A' ' 32' ' ' LEU . 23.7 mt -98.17 123.12 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 123.056 0.542 . . . . 0.0 110.478 -176.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.7 p -136.1 179.33 6.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.416 1.486 . . . . 0.0 107.692 172.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 89' ' ' ASP . 8.4 ptm180 -52.17 -56.36 15.06 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 123.558 0.743 . . . . 0.0 112.566 177.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -94.61 17.66 12.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.631 -0.668 . . . . 0.0 111.919 -175.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.0 t -70.55 -13.31 62.05 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.079 0.552 . . . . 0.0 111.165 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.448 ' HD3' HG23 ' A' ' 87' ' ' THR . 26.7 mmt180 71.51 177.06 0.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.145 1.378 . . . . 0.0 111.44 175.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.504 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 34.4 mtt -129.44 29.0 5.14 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.654 0.782 . . . . 0.0 111.401 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -56.78 -40.57 76.11 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.595 0.758 . . . . 0.0 110.659 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.03 -23.92 7.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.238 1.015 . . . . 0.0 110.597 174.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 5.0 mp -77.2 -30.17 54.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.682 0.793 . . . . 0.0 112.82 -166.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -166.03 89.18 0.4 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.4 0.68 . . . . 0.0 110.499 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -160.22 -33.65 0.06 Allowed 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.942 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -63.92 147.42 52.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.958 0.903 . . . . 0.0 111.424 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -55.76 -44.88 78.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.852 0.861 . . . . 0.0 112.422 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.3 tp -68.68 -39.28 80.63 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.732 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.519 HG13 ' HB1' ' A' ' 38' ' ' ALA . 81.0 t -65.8 -48.91 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 78.4 t -68.32 -38.82 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.753 0.821 . . . . 0.0 111.439 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 68.4 p -61.96 -55.66 27.13 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -61.65 -27.46 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.626 0.77 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 41.6 tp -64.26 -49.05 73.4 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.149 0.979 . . . . 0.0 109.852 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 85.2 p -68.24 -34.75 76.79 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.568 0.347 . . . . 0.0 111.26 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 63' ' ' SER . 85.1 mt -68.67 -33.09 73.39 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.703 0.801 . . . . 0.0 111.788 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' HG13 ' A' ' 34' ' ' VAL . 29.4 ttmt -85.5 -43.72 13.32 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.804 -175.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 94.3 mt -61.25 -27.9 68.78 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.534 0.734 . . . . 0.0 110.766 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -57.69 -40.2 78.91 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.575 1.15 . . . . 0.0 111.065 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -85.48 -45.77 11.5 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.19 0.596 . . . . 0.0 111.105 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.78 -51.96 35.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.129 0.972 . . . . 0.0 111.878 -170.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -123.51 -4.46 8.26 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.311 0.644 . . . . 0.0 112.176 -173.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.72 12.8 84.12 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-O 120.182 -0.232 . . . . 0.0 113.288 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.476 HG12 HG21 ' A' ' 78' ' ' VAL . 57.3 t -86.79 107.13 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.861 0.865 . . . . 0.0 109.406 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 m -136.89 156.33 48.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.447 1.099 . . . . 0.0 109.597 -171.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.04 35.25 90.36 Favored Glycine 0 C--N 1.354 1.549 0 O-C-N 123.672 0.607 . . . . 0.0 111.996 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 75' ' ' VAL . 20.5 m -119.62 4.21 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.387 1.075 . . . . 0.0 110.704 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 82' ' ' LEU . 7.1 p-10 -55.83 -37.94 69.38 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.496 1.119 . . . . 0.0 112.656 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.55 -50.93 71.99 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.789 0.681 . . . . 0.0 110.744 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.76 -23.52 64.33 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.921 -178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 79' ' ' ASP . 87.7 mt -73.27 -31.26 63.96 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.551 0.741 . . . . 0.0 111.19 175.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.21 -37.37 85.39 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.522 0.514 . . . . 0.0 109.774 171.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.99 -0.26 30.39 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.014 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 94' ' ' LEU . 79.6 mt -82.17 144.24 30.87 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 169.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.36 -8.44 2.56 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.992 0.917 . . . . 0.0 110.38 174.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.448 HG23 ' HD3' ' A' ' 51' ' ' ARG . 4.2 m -138.96 147.1 41.79 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.97 -31.91 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.676 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 38.2 t70 -56.79 -40.62 76.23 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.816 0.846 . . . . 0.0 110.059 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.71 -29.57 64.7 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.979 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.479 ' HB2' ' HE3' ' A' ' 52' ' ' MET . 67.1 tp -64.19 -45.52 87.98 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.218 0.607 . . . . 0.0 111.162 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -58.64 -45.55 89.06 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.682 0.614 . . . . 0.0 109.653 177.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 19.0 mm100 -61.78 -38.59 88.64 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.293 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -62.68 -61.79 2.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.042 0.937 . . . . 0.0 110.207 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.456 HG13 HG21 ' A' ' 75' ' ' VAL . 92.5 t -60.6 -44.53 97.02 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.129 -172.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -66.45 -35.62 80.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -67.36 -38.06 84.19 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.693 0.224 . . . . 0.0 111.475 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -84.34 -17.67 38.71 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.008 0.523 . . . . 0.0 111.981 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -82.3 -48.46 11.17 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.52 37.29 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.61 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.178 0 C-N-CA 124.685 1.194 . . . . 0.0 111.09 -177.603 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.6 ptm . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.2 -56.13 16.87 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.36 -35.53 80.59 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.034 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -70.5 -51.66 27.39 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.955 0.902 . . . . 0.0 110.742 -169.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HA ' HG12 ' A' ' 34' ' ' VAL . 4.1 mm? -66.95 -33.76 76.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.331 0.395 . . . . 0.0 110.154 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.5 -32.79 74.58 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 110.588 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' HG23 ' A' ' 37' ' ' VAL . 97.8 m -71.93 -51.32 22.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.427 0.691 . . . . 0.0 111.018 178.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' A' ' 31' ' ' LEU . 13.3 p -62.46 -31.65 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 122.208 0.203 . . . . 0.0 110.819 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.539 HD11 HD23 ' A' ' 91' ' ' LEU . 87.1 mt -73.16 -34.2 65.9 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.252 0.621 . . . . 0.0 111.439 173.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.6 t -64.64 -36.6 84.77 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.371 0.668 . . . . 0.0 111.12 177.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 33' ' ' THR . 22.0 t -82.77 -25.29 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.517 0.727 . . . . 0.0 110.224 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.56 -43.71 54.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.45 0.7 . . . . 0.0 111.453 178.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.8 p -86.94 -50.39 6.71 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.758 0.823 . . . . 0.0 110.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 122.78 -33.04 4.23 Favored Glycine 0 C--N 1.341 0.817 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.007 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.1 m -73.43 130.17 84.54 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 123.006 0.522 . . . . 0.0 111.124 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -54.77 157.53 12.52 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.397 2.731 . . . . 0.0 114.151 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -56.85 -27.4 60.24 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.358 1.063 . . . . 0.0 112.463 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -68.17 -21.37 64.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.757 0.823 . . . . 0.0 111.801 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -105.33 2.98 29.36 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.541 0.737 . . . . 0.0 111.545 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -113.04 120.91 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.293 0.637 . . . . 0.0 109.307 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.6 m -100.85 167.31 10.36 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.318 0.647 . . . . 0.0 109.302 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -71.29 -19.41 62.34 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.836 0.35 . . . . 0.0 110.757 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -123.23 79.23 1.65 Allowed 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.4 m -125.08 20.27 8.26 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.549 1.14 . . . . 0.0 108.929 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 56.08 -169.84 0.09 Allowed 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 112.312 -170.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 49.8 ttm -147.24 84.8 1.58 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.577 0.703 . . . . 0.0 109.254 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.36 -4.13 8.37 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.608 174.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -137.18 -36.41 0.66 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.333 0.653 . . . . 0.0 110.63 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 69.6 mt -66.64 -36.85 83.56 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -167.65 79.81 0.18 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.526 0.73 . . . . 0.0 110.142 177.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -147.76 -15.79 0.37 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.468 0.307 . . . . 0.0 111.327 -175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -91.7 150.22 21.24 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.719 0.808 . . . . 0.0 109.338 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -54.04 -45.86 71.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.92 0.888 . . . . 0.0 112.616 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.05 -36.1 74.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.716 0.407 . . . . 0.0 110.551 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.509 HG13 ' HB1' ' A' ' 38' ' ' ALA . 38.4 t -71.3 -40.35 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.214 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 51.3 t -69.81 -39.8 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.915 0.886 . . . . 0.0 110.291 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.488 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 41.5 t -64.37 -46.31 83.92 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.634 0.584 . . . . 0.0 110.264 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -62.19 -43.43 98.86 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.975 0.797 . . . . 0.0 110.563 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.57 -49.34 72.98 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.929 173.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.9 t -65.64 -22.79 66.69 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.159 0.984 . . . . 0.0 112.081 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 63' ' ' SER . 91.1 mt -67.61 -52.12 42.21 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -26.12 61.26 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.36 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.598 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 30.8 mt -67.79 -46.26 72.5 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 174.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -63.28 -42.24 99.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.023 0.929 . . . . 0.0 110.515 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -69.64 -46.4 66.25 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.51 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.33 -49.53 4.22 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.82 -168.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -97.75 -11.64 23.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.377 0.671 . . . . 0.0 111.982 -174.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.02 8.66 86.92 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 123.328 0.392 . . . . 0.0 113.968 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 46.2 t -86.46 108.21 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.35 0.66 . . . . 0.0 110.529 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.0 t -150.31 167.24 27.6 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.99 0.916 . . . . 0.0 109.756 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 24.32 75.14 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 112.046 -0.422 . . . . 0.0 112.046 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 31.6 m -126.09 18.19 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.431 1.092 . . . . 0.0 110.965 -172.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -51.85 -40.92 61.36 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.586 1.154 . . . . 0.0 113.2 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -70.1 -39.41 75.53 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.009 0.924 . . . . 0.0 110.681 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.26 -33.08 71.18 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.394 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.94 -29.84 62.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.715 0.806 . . . . 0.0 111.094 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -73.05 -32.54 65.12 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.969 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.41 -17.86 61.77 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.637 0.775 . . . . 0.0 110.632 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.04 132.96 55.05 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.218 0.607 . . . . 0.0 111.849 177.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.26 -6.55 5.37 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.985 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.6 p -139.94 154.35 47.19 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.412 0.625 . . . . 0.0 111.398 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.4 t -68.58 -40.81 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.771 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.479 ' HA ' ' HD2' ' A' ' 92' ' ' PHE . 9.4 t70 -64.94 -30.21 71.19 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.755 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.26 -41.38 81.16 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.259 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.539 HD23 HD11 ' A' ' 35' ' ' LEU . 59.6 tp -62.63 -42.08 99.39 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 123.464 0.477 . . . . 0.0 111.036 175.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.479 ' HD2' ' HA ' ' A' ' 89' ' ' ASP . 27.0 m-85 -54.57 -48.77 71.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.868 0.467 . . . . 0.0 110.525 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 79.7 mt-30 -68.96 -37.79 79.03 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.555 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.8 tt -57.46 -55.88 29.04 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.904 0.882 . . . . 0.0 110.2 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.9 t -61.26 -42.55 93.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.491 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -56.67 -42.44 79.01 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.266 0.979 . . . . 0.0 110.771 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 33.4 mmtp -66.64 -47.29 73.04 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.687 0.395 . . . . 0.0 111.737 -178.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -74.96 -18.43 60.39 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.976 0.51 . . . . 0.0 112.043 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -82.64 -55.41 4.47 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.539 0.736 . . . . 0.0 109.955 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.31 -26.69 62.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.751 0.82 . . . . 0.0 111.594 -176.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.651 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 170.792 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 23.1 ptm . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.46 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 42.9 mt-10 -59.05 -57.15 14.35 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.491 0.716 . . . . 0.0 112.767 -167.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.68 -25.29 67.88 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.984 0.803 . . . . 0.0 111.816 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.1 m80 -67.93 -45.41 74.4 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.64 0.587 . . . . 0.0 110.287 171.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 7.4 mp -67.26 -28.93 68.44 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.544 0.337 . . . . 0.0 111.495 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.536 ' HA ' HG21 ' A' ' 46' ' ' ILE . 8.4 mp -63.24 -38.7 92.18 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.696 0.399 . . . . 0.0 109.991 172.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -73.99 -34.11 64.07 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.086 0.866 . . . . 0.0 110.656 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.4 t -63.06 -58.06 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.141 0.576 . . . . 0.0 110.2 178.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.42 -40.77 97.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.548 0.739 . . . . 0.0 111.455 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.9 p -63.2 -56.9 12.8 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.467 0.479 . . . . 0.0 111.32 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.1 t -67.44 -41.38 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 C-N-CA 123.336 0.654 . . . . 0.0 111.271 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.69 -28.2 68.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.208 0.603 . . . . 0.0 112.145 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.9 m -92.9 -25.63 17.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.968 0.507 . . . . 0.0 111.394 177.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.88 17.15 58.53 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 123.001 0.334 . . . . 0.0 112.915 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.4 m -102.11 160.76 25.46 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 124.617 1.167 . . . . 0.0 109.945 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -70.23 158.67 55.62 Favored 'Trans proline' 0 C--N 1.368 1.595 0 C-N-CA 122.323 2.015 . . . . 0.0 112.692 168.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -64.76 -20.01 66.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.81 0.844 . . . . 0.0 111.182 173.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.94 -31.52 65.05 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.286 1.034 . . . . 0.0 110.97 173.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -96.4 15.84 20.2 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.99 0.916 . . . . 0.0 111.104 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.536 HG21 ' HA ' ' A' ' 32' ' ' LEU . 21.1 mm -123.46 141.11 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.69 0.796 . . . . 0.0 109.621 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 p -155.43 -168.6 2.88 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.173 0.989 . . . . 0.0 109.706 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.465 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 62.0 mtp85 -75.18 -9.09 58.23 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 176.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -162.71 92.93 0.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 161.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.7 t -106.27 14.13 27.89 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.191 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.685 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 44.8 mmt-85 60.84 104.5 0.02 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 124.37 1.068 . . . . 0.0 111.757 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.49 ' SD ' HD22 ' A' ' 91' ' ' LEU . 71.4 mtm -74.38 -2.16 24.13 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.936 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.685 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 12.7 pt-20 -61.06 -31.41 71.06 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.144 0.578 . . . . 0.0 110.908 173.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -87.51 -39.53 15.09 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.766 0.826 . . . . 0.0 109.986 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.9 mt -81.87 -86.49 0.1 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.724 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -104.44 80.37 1.68 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.497 0.719 . . . . 0.0 110.199 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -145.0 -11.05 0.57 Allowed 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.809 -177.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.45 148.02 26.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -53.8 -40.23 66.16 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.164 0.985 . . . . 0.0 112.638 -174.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -74.39 -39.03 62.94 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.09 0.556 . . . . 0.0 110.708 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 22.7 t -70.9 -37.23 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 116.795 -0.184 . . . . 0.0 110.983 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.4 t -68.62 -34.03 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 123.583 0.753 . . . . 0.0 110.011 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.1 t -67.22 -42.15 84.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.876 0.47 . . . . 0.0 110.73 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.86 -23.09 52.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.084 0.954 . . . . 0.0 111.643 177.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.13 -50.28 42.16 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 173.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.5 t -60.96 -41.96 97.35 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.48 1.112 . . . . 0.0 110.772 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.0 tp -57.93 -48.87 78.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.539 1.136 . . . . 0.0 110.715 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -68.33 -40.85 81.48 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.141 0.976 . . . . 0.0 111.073 -175.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.42 ' HA ' ' HD1' ' A' ' 73' ' ' PHE . 90.1 mt -65.13 -41.57 94.71 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.499 0.72 . . . . 0.0 110.591 179.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -70.59 -34.69 72.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.67 0.788 . . . . 0.0 111.121 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -77.78 -62.74 1.57 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.963 0.505 . . . . 0.0 111.461 -172.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.15 -50.89 17.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.911 0.485 . . . . 0.0 111.836 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' A' ' 69' ' ' LEU . 32.8 m-85 -91.92 -31.02 15.81 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.256 0.623 . . . . 0.0 111.689 -168.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.79 5.79 80.78 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.741 -173.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.632 HG21 HG13 ' A' ' 95' ' ' VAL . 88.3 t -77.11 87.68 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 122.106 0.955 . . . . 0.0 109.638 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.0 m -101.68 162.06 13.19 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 114.063 -1.426 . . . . 0.0 109.928 -177.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.84 38.85 93.26 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 123.503 0.502 . . . . 0.0 113.094 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.481 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 17.4 m -113.89 5.16 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.971 0.909 . . . . 0.0 111.443 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.59 -46.18 84.33 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.855 1.262 . . . . 0.0 112.723 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.48 -37.74 87.72 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.483 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.551 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 7.6 mp0 -66.69 -40.46 88.54 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.615 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 85.3 mt -59.98 -37.13 78.72 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.568 0.747 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.53 -38.63 87.57 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.059 174.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.03 -20.7 59.47 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.26 0.624 . . . . 0.0 111.719 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 95.5 mt -84.09 154.02 23.43 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.443 0.697 . . . . 0.0 112.066 -176.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.521 ' HG3' HG23 ' A' ' 87' ' ' THR . 9.3 pt-20 -136.48 -37.61 0.69 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 109.196 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HG3' ' A' ' 86' ' ' GLU . 11.9 p -102.56 143.28 32.46 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 125.675 1.59 . . . . 0.0 110.538 -173.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.3 t -77.81 -25.81 14.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.173 -173.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -64.81 -39.88 94.3 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.569 0.699 . . . . 0.0 109.854 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.503 ' HA ' HE21 ' A' ' 93' ' ' GLN . 3.9 mp0 -65.47 -36.27 83.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.921 173.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.49 HD22 ' SD ' ' A' ' 52' ' ' MET . 63.7 tp -66.4 -35.25 79.86 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.998 0.519 . . . . 0.0 111.397 172.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.465 ' HE2' ' HA ' ' A' ' 48' ' ' ARG . 21.5 m-85 -66.16 -51.73 55.05 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.285 0.634 . . . . 0.0 110.506 178.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.503 HE21 ' HA ' ' A' ' 90' ' ' GLU . 29.4 pt20 -70.08 -18.51 63.26 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.566 0.347 . . . . 0.0 111.513 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 85' ' ' LEU . 64.9 tp -68.99 -47.7 64.92 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.962 0.505 . . . . 0.0 110.614 171.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.632 HG13 HG21 ' A' ' 75' ' ' VAL . 75.9 t -64.56 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.53 0.732 . . . . 0.0 110.229 176.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 93' ' ' GLN . 33.1 tt0 -60.94 -40.8 94.68 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.543 1.137 . . . . 0.0 110.688 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 6.6 tmtt? -63.58 -44.04 95.2 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.301 1.04 . . . . 0.0 109.71 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.8 -24.28 52.81 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.45 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -86.98 -39.05 16.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 123.339 0.399 . . . . 0.0 110.985 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.69 -56.64 4.26 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.461 0.704 . . . . 0.0 109.917 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 172.415 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 44.4 mt-10 -62.71 -56.84 14.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.697 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -58.82 -37.24 75.96 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 124.518 1.136 . . . . 0.0 111.752 -173.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -67.94 -45.45 74.25 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.275 0.63 . . . . 0.0 111.141 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -70.14 -28.62 65.51 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 35' ' ' LEU . 9.4 tp -73.82 -27.04 60.91 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.269 1.028 . . . . 0.0 109.903 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 m -70.32 -42.38 72.0 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.741 0.816 . . . . 0.0 109.606 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.54 -42.95 77.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.313 0.645 . . . . 0.0 110.525 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 32' ' ' LEU . 90.1 mt -67.58 -39.67 84.84 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.11 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 76.4 p -71.6 -29.33 64.57 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.843 0.457 . . . . 0.0 111.191 -176.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -75.15 -40.07 43.77 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 C-N-CA 123.063 0.545 . . . . 0.0 110.312 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.44 -35.55 75.78 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.747 0.819 . . . . 0.0 112.023 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 78.1 p -91.81 -55.6 3.41 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.267 0.627 . . . . 0.0 110.766 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.61 -26.85 5.88 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.072 -175.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.67 148.75 66.34 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.347 0.659 . . . . 0.0 110.408 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.475 ' HD2' ' HG3' ' A' ' 45' ' ' GLU . 76.7 Cg_exo -53.55 159.21 6.73 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 123.396 2.731 . . . . 0.0 113.99 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 8.8 mtmp? -60.42 -36.42 78.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.986 0.914 . . . . 0.0 110.692 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.02 -8.75 57.97 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.057 0.943 . . . . 0.0 112.046 -177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.475 ' HG3' ' HD2' ' A' ' 42' ' ' PRO . 34.6 mm-40 -90.89 -3.79 57.06 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.647 0.779 . . . . 0.0 110.743 170.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.4 mt -115.45 138.71 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.157 0.983 . . . . 0.0 109.323 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -133.77 161.98 33.23 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.007 0.923 . . . . 0.0 108.667 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.71 -34.6 78.21 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.8 -20.16 60.97 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.926 1.291 . . . . 0.0 112.445 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -74.05 155.99 37.95 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.263 1.025 . . . . 0.0 111.429 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -91.87 176.47 6.51 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.622 0.769 . . . . 0.0 110.326 173.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 55.3 mtt -110.58 111.97 23.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.687 0.795 . . . . 0.0 110.639 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -135.51 -53.33 0.77 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 174.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.95 -38.07 9.14 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.072 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 39' ' ' SER . 56.5 mt -66.28 -43.14 87.21 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.552 -170.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.55 84.95 0.17 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.976 0.798 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -152.56 -48.23 0.1 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.319 0.248 . . . . 0.0 110.54 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 61' ' ' VAL . 18.3 t70 -62.92 144.14 57.03 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.56 0.538 . . . . 0.0 110.048 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.7 p -55.7 -44.74 77.67 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 111.702 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.88 -40.03 94.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.688 0.795 . . . . 0.0 111.087 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 58' ' ' ASP . 93.1 t -62.81 -43.5 98.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.03 0.532 . . . . 0.0 110.724 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.67 -30.83 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.031 0.933 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.0 m -66.46 -42.73 87.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.479 0.712 . . . . 0.0 110.108 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.41 -32.56 64.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.163 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.92 -46.18 82.74 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 0.0 110.317 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.0 p -70.61 -30.45 67.11 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.689 0.796 . . . . 0.0 111.028 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.54 -39.11 85.01 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.713 0.805 . . . . 0.0 109.619 173.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 5.9 mptp? -66.49 -44.12 83.53 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 123.521 0.728 . . . . 0.0 109.515 174.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.3 mt -64.0 -27.03 68.84 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.357 0.411 . . . . 0.0 111.259 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -49.49 77.62 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.434 0.693 . . . . 0.0 110.147 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -72.21 -43.39 64.53 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.377 -175.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 15.1 mm-40 -82.61 -52.32 6.92 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.693 0.797 . . . . 0.0 111.102 -168.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -126.31 0.57 7.04 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -171.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 70.47 6.47 58.39 Favored Glycine 0 N--CA 1.478 1.489 0 CA-C-O 119.777 -0.457 . . . . 0.0 114.031 -177.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 90.6 t -80.4 124.2 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.161 0.984 . . . . 0.0 110.674 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.2 m -149.0 155.72 41.21 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.715 0.806 . . . . 0.0 109.798 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.43 -18.2 57.47 Favored Glycine 0 C--N 1.348 1.223 0 CA-C-N 116.421 -0.354 . . . . 0.0 112.518 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.1 m -79.84 8.42 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 124.543 1.137 . . . . 0.0 112.144 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.35 -40.39 61.9 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.745 1.218 . . . . 0.0 112.145 -176.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.04 -46.3 81.87 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.978 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -68.66 -28.58 67.01 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.042 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.59 -37.8 77.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.103 0.961 . . . . 0.0 109.806 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.44 -32.25 73.79 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.255 174.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -79.18 -16.45 56.58 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.1 mt -70.75 138.45 50.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.586 0.354 . . . . 0.0 110.205 175.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -125.79 -11.53 6.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.531 0.732 . . . . 0.0 109.581 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.408 ' HB ' ' HG3' ' A' ' 90' ' ' GLU . 2.0 m -135.9 146.91 47.88 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 123.081 0.552 . . . . 0.0 109.979 -175.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.39 -30.32 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.267 -174.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -52.5 -49.12 65.39 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 123.48 0.488 . . . . 0.0 110.459 170.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HB ' ' A' ' 87' ' ' THR . 47.4 mt-10 -61.16 -40.15 92.78 Favored 'General case' 0 C--N 1.35 0.6 0 O-C-N 124.499 1.124 . . . . 0.0 110.877 -176.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.73 -48.66 78.25 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.707 0.63 . . . . 0.0 111.785 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.435 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 9.3 m-85 -58.18 -39.1 78.04 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.485 0.49 . . . . 0.0 110.693 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -77.31 -31.83 54.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.662 0.601 . . . . 0.0 111.46 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.31 -55.38 8.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.18 0.592 . . . . 0.0 109.925 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.3 -43.92 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.482 1.113 . . . . 0.0 110.634 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -63.54 -40.93 98.29 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.973 0.796 . . . . 0.0 111.289 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.85 -29.39 66.62 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.201 0.6 . . . . 0.0 111.083 -177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -78.4 -36.97 45.07 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.626 0.77 . . . . 0.0 110.959 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.88 -37.42 55.55 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.512 1.125 . . . . 0.0 110.868 -176.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.76 -46.35 11.49 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.551 0.74 . . . . 0.0 109.902 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.222 0 C-N-CA 124.754 1.222 . . . . 0.0 112.305 175.487 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 CA-C-O 120.287 0.089 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -61.74 -40.03 93.65 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.29 0.994 . . . . 0.0 110.918 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.4 -43.09 95.49 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.6 m-70 -69.03 -37.06 78.41 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.638 0.775 . . . . 0.0 110.801 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.2 tp -71.25 -39.39 71.64 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.289 0.636 . . . . 0.0 111.071 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 9.2 mp -69.0 -32.48 72.06 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.843 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.7 m -70.58 -34.35 72.09 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.696 0.399 . . . . 0.0 110.713 173.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 68' ' ' LYS . 20.4 t -56.83 -46.87 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.361 0.664 . . . . 0.0 109.772 172.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -68.3 -36.68 79.71 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.962 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.3 p -68.33 -36.16 78.86 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.826 0.45 . . . . 0.0 111.751 -176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.3 -27.63 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.261 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.37 -41.72 63.06 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.162 0.585 . . . . 0.0 111.341 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.3 p -91.2 -63.07 1.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.468 0.707 . . . . 0.0 111.137 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.55 -38.58 1.56 Allowed Glycine 0 C--N 1.343 0.971 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -68.37 141.91 94.01 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.347 0.659 . . . . 0.0 110.368 175.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.441 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 56.6 Cg_endo -67.08 158.16 58.19 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.795 2.33 . . . . 0.0 111.639 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.745 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 20.5 pttm -68.15 -18.41 64.61 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.24 -31.11 65.2 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 124.226 1.011 . . . . 0.0 111.668 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 15.7 mm-40 -85.57 -23.98 27.41 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.865 0.866 . . . . 0.0 111.502 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -87.16 142.45 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 123.586 0.754 . . . . 0.0 111.051 -172.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.0 t -150.15 177.94 9.44 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.522 1.129 . . . . 0.0 109.195 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.7 mtt-85 -69.86 -24.7 63.47 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.87 0.468 . . . . 0.0 110.599 172.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -65.8 -32.39 73.9 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.102 0.876 . . . . 0.0 110.814 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.8 m -60.34 106.64 0.55 Allowed 'General case' 0 C--N 1.357 0.917 0 O-C-N 124.337 1.023 . . . . 0.0 110.551 -177.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.4 mtt-85 -81.4 155.48 25.88 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 169.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.8 mmt -69.68 90.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.789 0.68 . . . . 0.0 109.823 -176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -103.11 -18.09 15.1 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.276 1.03 . . . . 0.0 110.404 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -155.35 -47.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.949 1.3 . . . . 0.0 107.703 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.522 ' H ' HD12 ' A' ' 55' ' ' LEU . 1.6 mp -59.23 122.68 14.45 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.588 172.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.648 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . 53.75 21.88 2.9 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.098 0.959 . . . . 0.0 113.557 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -115.78 19.49 15.16 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 121.774 0.797 . . . . 0.0 111.41 -172.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 61' ' ' VAL . 24.3 t70 -147.79 149.12 31.76 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 172.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.3 p -50.0 -42.65 49.53 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.972 1.309 . . . . 0.0 113.147 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.3 -38.19 74.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 110.87 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.45 HG12 ' H ' ' A' ' 56' ' ' ALA . 25.2 t -76.15 -28.49 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.424 0.69 . . . . 0.0 111.304 -176.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.525 HG13 ' HB2' ' A' ' 82' ' ' LEU . 60.1 t -73.07 -43.26 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 124.096 0.959 . . . . 0.0 109.456 175.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.4 t -60.96 -43.06 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.838 0.711 . . . . 0.0 110.053 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 9.9 tp10 -65.65 -38.32 89.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.377 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.648 HD22 ' HB2' ' A' ' 56' ' ' ALA . 45.2 tp -64.23 -45.51 87.89 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 124.143 0.902 . . . . 0.0 110.521 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.6 t -65.44 -44.53 86.98 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.627 0.771 . . . . 0.0 111.292 -177.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.6 mt -67.53 -30.89 70.66 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.795 0.838 . . . . 0.0 111.219 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 34' ' ' VAL . 5.5 tppt? -72.84 -46.24 54.02 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 123.79 0.681 . . . . 0.0 109.409 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 98.9 mt -62.73 -32.17 73.23 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.637 174.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -67.28 -30.16 69.95 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.627 1.171 . . . . 0.0 111.803 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -93.4 -48.95 6.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.833 0.453 . . . . 0.0 110.658 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -65.05 -53.86 39.23 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.992 0.807 . . . . 0.0 111.334 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -110.37 -23.5 11.15 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.421 0.688 . . . . 0.0 112.088 -172.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.34 13.91 64.91 Favored Glycine 0 N--CA 1.478 1.477 0 CA-C-N 117.739 0.245 . . . . 0.0 112.837 -172.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.591 HG21 HG13 ' A' ' 95' ' ' VAL . 96.4 t -91.6 115.88 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.41 0.684 . . . . 0.0 110.224 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 15.2 t -149.27 169.68 20.21 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 124.247 1.019 . . . . 0.0 109.598 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.48 -2.79 87.63 Favored Glycine 0 C--N 1.345 1.057 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.564 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.425 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 27.8 m -98.36 17.75 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.699 1.2 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.58 -53.56 29.53 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.296 1.438 . . . . 0.0 112.172 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.15 -39.68 87.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.03 -23.05 61.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.992 0.917 . . . . 0.0 111.233 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HB2' HG13 ' A' ' 62' ' ' VAL . 81.7 mt -71.59 -33.48 69.09 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.404 0.682 . . . . 0.0 110.351 173.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -62.27 -40.23 95.53 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.602 0.564 . . . . 0.0 110.795 170.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.85 -24.07 63.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.322 0.649 . . . . 0.0 111.754 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.6 124.82 24.65 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 174.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -117.88 6.21 12.23 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.343 0.657 . . . . 0.0 109.324 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.7 p -145.38 143.44 30.11 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.893 0.877 . . . . 0.0 110.836 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.61 -32.09 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.646 172.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.72 -42.66 97.89 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.186 0.595 . . . . 0.0 111.633 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -27.79 63.63 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.502 0.321 . . . . 0.0 111.193 174.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -63.42 -38.65 91.96 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.346 0.258 . . . . 0.0 110.809 170.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -56.87 -58.44 8.14 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.399 0.679 . . . . 0.0 111.064 176.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -64.52 -29.7 70.73 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.826 0.704 . . . . 0.0 111.489 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.9 -56.71 10.39 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.517 0.511 . . . . 0.0 110.999 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.591 HG13 HG21 ' A' ' 75' ' ' VAL . 96.9 t -59.77 -48.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 O-C-N 123.73 0.644 . . . . 0.0 110.728 -177.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -65.22 -46.15 81.84 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.575 0.75 . . . . 0.0 112.869 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -65.06 -47.47 77.19 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.813 0.339 . . . . 0.0 110.41 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.48 -17.56 60.75 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.126 0.97 . . . . 0.0 111.968 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.555 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -80.79 -46.31 15.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.064 0.545 . . . . 0.0 109.91 176.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.1 -32.38 66.94 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.281 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.915 0 C-N-CA 124.765 1.226 . . . . 0.0 108.746 177.02 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.5 ptt? . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.537 -0.745 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -47.02 -63.2 1.1 Allowed 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -168.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.4 -26.22 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.302 0.641 . . . . 0.0 111.159 -178.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 m170 -75.52 -35.81 60.67 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.08 0.952 . . . . 0.0 111.018 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -77.73 -34.31 52.62 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.37 -31.43 71.66 Favored 'General case' 0 CA--C 1.559 1.323 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.138 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 m -67.53 -41.81 83.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.645 0.778 . . . . 0.0 110.717 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.66 -43.75 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.496 0.719 . . . . 0.0 110.788 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.16 -33.53 76.22 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.495 0.718 . . . . 0.0 111.199 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.2 t -64.38 -36.98 85.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.353 0.661 . . . . 0.0 111.22 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.41 -48.73 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.827 176.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.6 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -67.12 -29.34 69.04 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.161 0.985 . . . . 0.0 112.398 -171.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.407 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 84.5 p -91.15 -52.61 4.74 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.123 0.569 . . . . 0.0 109.518 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.29 -10.44 28.78 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.761 -175.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.403 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -80.61 156.91 72.85 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.212 0.605 . . . . 0.0 110.071 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.46 155.9 59.7 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.281 1.987 . . . . 0.0 112.546 172.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -60.27 -23.31 64.03 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.286 1.034 . . . . 0.0 112.077 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -63.53 -38.07 89.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.209 1.003 . . . . 0.0 111.713 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -87.1 -0.9 57.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.451 0.7 . . . . 0.0 112.347 -174.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.56 HG23 HD13 ' A' ' 55' ' ' LEU . 44.1 mt -98.36 137.86 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.166 0.586 . . . . 0.0 109.937 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 t -144.38 151.8 39.79 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.302 0.641 . . . . 0.0 109.367 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.434 ' NH1' ' HB2' ' A' ' 49' ' ' ASP . 5.0 ppt_? -62.78 -30.99 71.88 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 123.765 0.666 . . . . 0.0 109.667 167.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.434 ' HB2' ' NH1' ' A' ' 48' ' ' ARG . 34.5 t70 -83.42 80.22 9.16 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 123.55 0.74 . . . . 0.0 109.148 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.4 t -165.27 147.5 7.81 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.698 -177.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -85.82 27.27 0.88 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.292 0.637 . . . . 0.0 110.462 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 15.6 mmt 68.11 36.22 3.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.63 1.172 . . . . 0.0 110.023 -165.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -59.26 88.2 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.39 1.076 . . . . 0.0 111.726 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 64.91 11.33 6.91 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.164 1.385 . . . . 0.0 112.024 -178.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.56 HD13 HG23 ' A' ' 46' ' ' ILE . 83.9 mt -97.02 -40.96 8.6 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.553 0.741 . . . . 0.0 110.925 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.681 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -158.51 -167.15 2.08 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.839 0.856 . . . . 0.0 109.984 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.4 t80 81.84 -27.51 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 125.829 1.652 . . . . 0.0 112.098 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.7 136.49 56.87 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.584 0.754 . . . . 0.0 109.947 167.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.0 m -52.61 -44.0 65.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 112.967 -173.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.2 tp -69.73 -38.43 76.87 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.88 0.472 . . . . 0.0 110.818 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.6 HG13 ' HB1' ' A' ' 38' ' ' ALA . 49.1 t -66.86 -37.5 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.711 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.6 t -67.88 -34.38 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 123.343 0.657 . . . . 0.0 110.463 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.1 m -61.85 -49.43 76.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.198 0.599 . . . . 0.0 110.264 175.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -66.91 -37.71 84.86 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.107 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 55.3 tp -68.04 -43.64 78.23 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.774 0.829 . . . . 0.0 110.398 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.2 t -65.48 -43.01 91.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.42 0.688 . . . . 0.0 110.839 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.64 -36.58 84.29 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.124 0.89 . . . . 0.0 110.55 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -70.54 -50.93 32.42 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.334 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 95.7 mt -60.25 -38.38 83.3 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.613 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -59.0 -53.96 52.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.156 0.982 . . . . 0.0 112.17 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -84.91 -62.94 1.42 Allowed 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.818 0.342 . . . . 0.0 110.888 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -65.69 -47.76 74.36 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.008 0.923 . . . . 0.0 112.218 -166.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -91.2 -20.77 21.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.137 0.575 . . . . 0.0 111.813 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.55 0.57 89.38 Favored Glycine 0 C--N 1.352 1.429 0 N-CA-C 113.87 0.308 . . . . 0.0 113.87 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.88 108.82 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 124.286 1.034 . . . . 0.0 109.941 -177.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -133.27 166.47 22.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.155 0.582 . . . . 0.0 110.584 -176.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.29 18.02 79.76 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-N 116.334 -0.394 . . . . 0.0 112.475 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.9 m -110.42 15.79 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.484 1.114 . . . . 0.0 110.614 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.22 -45.24 88.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.709 1.204 . . . . 0.0 111.939 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.402 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 24.7 m-20 -68.35 -36.47 79.28 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.694 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.95 -27.96 64.12 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.188 0.595 . . . . 0.0 111.199 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 99.3 mt -74.32 -26.88 60.43 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.51 0.724 . . . . 0.0 110.853 175.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.11 -37.31 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.184 171.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 80' ' ' ASP . 86.9 mt -84.86 16.35 3.4 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.096 0.958 . . . . 0.0 112.636 -176.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.23 127.32 32.66 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.013 0.435 . . . . 0.0 111.231 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -93.07 -58.65 2.25 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.344 176.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.0 p -119.65 169.34 10.18 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.503 HG22 ' SD ' ' A' ' 52' ' ' MET . 47.6 t -70.07 -33.38 54.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.685 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.64 -40.01 90.38 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.031 0.933 . . . . 0.0 110.611 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -58.78 -43.13 90.33 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.357 1.063 . . . . 0.0 110.54 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 44.0 tp -61.37 -46.09 91.65 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.485 0.714 . . . . 0.0 111.945 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -58.73 -42.96 89.94 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 123.377 0.423 . . . . 0.0 111.081 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.28 -37.53 83.56 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.823 0.449 . . . . 0.0 111.481 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.51 -57.75 10.05 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.374 0.67 . . . . 0.0 110.903 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.15 -35.37 71.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.448 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.98 -45.04 90.82 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.206 1.002 . . . . 0.0 111.473 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -65.57 -41.3 93.09 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.807 -178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -79.97 -17.53 52.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.337 0.655 . . . . 0.0 111.975 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -72.22 -44.88 62.26 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.743 0.817 . . . . 0.0 109.453 174.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.29 -66.26 0.87 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.062 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.492 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.283 176.136 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.7 tmm? . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -65.61 -62.97 1.21 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.391 0.677 . . . . 0.0 112.395 -166.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.85 -34.81 73.61 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.652 0.781 . . . . 0.0 110.85 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -68.58 -35.55 77.53 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.466 0.706 . . . . 0.0 111.636 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.502 HD21 ' HG ' ' A' ' 91' ' ' LEU . 59.2 tp -71.7 -36.6 70.6 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 tp -61.76 -36.93 82.46 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.918 0.887 . . . . 0.0 110.623 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 m -70.43 -40.0 74.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.837 0.855 . . . . 0.0 110.405 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.6 t -60.56 -38.79 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.902 0.881 . . . . 0.0 110.538 176.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 91' ' ' LEU . 95.9 mt -72.62 -33.95 67.01 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.753 0.821 . . . . 0.0 111.287 177.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.1 t -60.85 -38.09 84.34 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.468 0.48 . . . . 0.0 110.694 176.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.3 t -79.61 -37.14 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.686 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.56 71.52 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 0.0 111.979 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m -88.7 -40.33 13.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.595 0.758 . . . . 0.0 110.471 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.36 -32.02 7.36 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.0 -175.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.5 m -73.84 143.63 81.6 Favored Pre-proline 0 CA--C 1.556 1.189 0 C-N-CA 123.583 0.753 . . . . 0.0 110.233 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.93 168.9 8.12 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.849 2.366 . . . . 0.0 113.532 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -63.39 -25.71 68.41 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.984 0.913 . . . . 0.0 112.149 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -69.07 -27.91 66.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.384 1.074 . . . . 0.0 110.854 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -76.83 -23.09 52.77 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.823 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.578 HG23 HD13 ' A' ' 55' ' ' LEU . 21.2 mt -109.0 144.24 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.749 0.819 . . . . 0.0 110.222 -173.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.7 t -156.07 170.8 21.35 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.012 1.325 . . . . 0.0 108.135 174.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -62.27 -32.66 73.4 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.97 0.508 . . . . 0.0 110.417 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -95.04 -1.65 51.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.421 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.3 m -71.74 -6.15 39.2 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.028 0.531 . . . . 0.0 112.339 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 72.4 mtp85 68.47 170.45 0.28 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.872 1.269 . . . . 0.0 112.638 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.781 ' HG3' ' HB2' ' A' ' 57' ' ' PHE . 44.7 tpp -112.63 90.88 3.46 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.181 -172.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 57' ' ' PHE . 10.3 tp10 -109.84 -68.73 0.9 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.139 0.976 . . . . 0.0 109.921 176.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -116.18 -18.47 10.57 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.95 0.9 . . . . 0.0 110.824 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.578 HD13 HG23 ' A' ' 46' ' ' ILE . 84.3 mt -60.95 -32.75 72.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.268 1.027 . . . . 0.0 112.842 -171.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.504 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.37 13.96 0.06 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.393 0.677 . . . . 0.0 112.072 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.781 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 81.6 t80 -100.17 -32.22 11.01 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.538 0.335 . . . . 0.0 110.936 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -55.6 133.43 50.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.901 -0.571 . . . . 0.0 109.568 176.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.8 t -52.95 -37.86 61.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.371 1.069 . . . . 0.0 113.022 -170.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 53.1 tp -68.46 -43.98 75.83 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 123.48 0.488 . . . . 0.0 110.492 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.69 -28.53 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.4 t -67.34 -49.14 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.258 0.623 . . . . 0.0 110.241 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.9 m -63.59 -40.14 96.18 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 124.022 0.826 . . . . 0.0 110.718 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -67.14 -41.09 86.66 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.112 0.965 . . . . 0.0 111.051 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.5 HD22 ' HB1' ' A' ' 56' ' ' ALA . 35.0 tp -67.66 -48.87 65.44 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 123.453 0.47 . . . . 0.0 110.209 -175.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.0 t -64.22 -32.71 74.4 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.796 0.438 . . . . 0.0 110.742 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 9.9 tt -63.5 -52.36 61.58 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.243 1.017 . . . . 0.0 109.955 176.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.442 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.1 OUTLIER -74.09 -42.67 59.77 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.572 -173.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.505 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 60.8 mt -61.43 -28.99 69.66 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.101 176.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 45.9 ttp180 -57.16 -32.09 66.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.232 1.013 . . . . 0.0 111.681 177.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -97.14 -50.83 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.773 0.829 . . . . 0.0 111.046 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 25.4 mm-40 -62.28 -53.02 61.1 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.379 1.072 . . . . 0.0 112.226 -171.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -120.53 -4.36 9.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.219 0.607 . . . . 0.0 111.822 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.64 20.06 79.77 Favored Glycine 0 C--N 1.351 1.392 0 C-N-CA 123.364 0.507 . . . . 0.0 114.146 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.507 HG21 HG13 ' A' ' 95' ' ' VAL . 51.0 t -90.93 117.41 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.704 0.802 . . . . 0.0 109.532 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.8 m -145.41 150.25 36.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.008 0.923 . . . . 0.0 110.672 -171.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.41 15.8 78.96 Favored Glycine 0 C--N 1.359 1.825 0 O-C-N 123.555 0.534 . . . . 0.0 112.861 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.22 8.19 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.328 1.051 . . . . 0.0 111.055 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 3.1 m-20 -54.0 -43.04 69.72 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 125.206 1.403 . . . . 0.0 112.29 -173.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.3 -43.77 96.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 113.765 -1.561 . . . . 0.0 110.051 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 30.5 tt0 -73.43 -28.89 62.22 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.721 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.432 HD23 HD13 ' A' ' 94' ' ' LEU . 93.0 mt -62.8 -37.97 88.82 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.077 0.951 . . . . 0.0 110.265 176.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.29 -39.03 75.1 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.036 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.78 -14.21 62.88 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 94' ' ' LEU . 57.7 mt -70.82 123.2 21.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.887 0.475 . . . . 0.0 110.451 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' HG3' HG23 ' A' ' 87' ' ' THR . 10.7 pt-20 -93.12 -22.78 18.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.583 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.501 HG23 ' HG3' ' A' ' 86' ' ' GLU . 67.5 p -133.81 159.14 41.53 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.571 0.748 . . . . 0.0 111.122 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 t -69.22 -26.89 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.116 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 93' ' ' GLN . 33.0 t70 -61.11 -43.91 98.16 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.191 0.596 . . . . 0.0 110.408 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HB3' HD22 ' A' ' 85' ' ' LEU . 74.0 mm-40 -60.62 -32.38 71.52 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 123.882 0.739 . . . . 0.0 111.545 172.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 35' ' ' LEU . 34.0 tp -67.83 -41.41 83.07 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 175.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -60.8 -40.37 92.42 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.956 0.408 . . . . 0.0 109.927 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 89' ' ' ASP . 76.7 mt-30 -64.1 -40.41 96.17 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.117 174.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 85' ' ' LEU . 6.1 tt -59.64 -49.94 75.8 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.264 1.026 . . . . 0.0 110.907 -176.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.507 HG13 HG21 ' A' ' 75' ' ' VAL . 63.3 t -62.87 -50.81 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -65.11 -24.26 67.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 123.816 0.698 . . . . 0.0 112.435 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -67.33 -51.59 50.57 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.24 1.016 . . . . 0.0 109.854 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -82.49 -16.56 48.32 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.402 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -41.4 28.25 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.22 1.008 . . . . 0.0 109.33 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.35 -51.78 9.59 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.47 0.708 . . . . 0.0 110.677 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 176.596 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HA ' ' HE1' ' A' ' 92' ' ' PHE . 51.3 mt-10 -59.93 -53.03 62.69 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 123.347 0.659 . . . . 0.0 110.492 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.83 -34.79 78.97 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.241 -179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -64.11 -38.26 90.43 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.409 0.683 . . . . 0.0 111.867 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 58.3 mt -69.16 -38.55 78.79 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.175 0.512 . . . . 0.0 111.016 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tp -67.86 -37.39 81.77 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.952 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.6 m -76.13 -37.51 57.93 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.653 1.181 . . . . 0.0 110.936 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 31' ' ' LEU . 11.7 p -68.96 -35.4 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 117.78 0.264 . . . . 0.0 110.614 -176.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.406 HD22 ' HB2' ' A' ' 56' ' ' ALA . 91.0 mt -67.64 -39.74 84.6 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.543 173.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.1 t -59.65 -51.73 68.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.678 0.791 . . . . 0.0 111.733 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.4 t -71.04 -45.8 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 123.958 0.903 . . . . 0.0 111.335 -174.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.32 80.48 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.045 0.538 . . . . 0.0 111.627 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.6 m -85.93 -15.89 40.21 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.933 0.493 . . . . 0.0 111.666 178.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.02 6.73 89.02 Favored Glycine 0 C--N 1.352 1.468 0 C-N-CA 122.739 0.209 . . . . 0.0 113.495 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.752 HG21 HD23 ' A' ' 55' ' ' LEU . 27.1 m -88.44 161.52 42.37 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 124.923 1.289 . . . . 0.0 111.003 -178.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.23 149.03 92.11 Favored 'Trans proline' 0 C--N 1.367 1.529 0 C-N-CA 122.416 2.077 . . . . 0.0 111.36 162.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -70.04 -19.26 63.31 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.239 0.616 . . . . 0.0 110.53 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.37 -27.46 64.25 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.132 0.973 . . . . 0.0 112.65 172.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.83 -16.85 61.6 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.89 0.876 . . . . 0.0 111.454 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.13 125.19 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.666 0.786 . . . . 0.0 111.081 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.3 t -125.8 177.11 6.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.438 1.095 . . . . 0.0 108.066 168.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -68.52 -39.08 81.34 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 122.559 0.344 . . . . 0.0 110.982 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.36 -3.68 58.44 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.8 0.84 . . . . 0.0 112.025 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -72.36 164.69 25.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.229 0.612 . . . . 0.0 111.986 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 0.0 OUTLIER -110.38 132.39 54.22 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.377 0.608 . . . . 0.0 110.361 173.355 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 24.9 ptp -80.68 67.71 6.65 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 122.339 1.066 . . . . 0.0 109.104 171.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -86.14 -70.77 0.58 Allowed 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.54 -30.99 67.88 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 172.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.752 HD23 HG21 ' A' ' 41' ' ' VAL . 2.7 mp -91.07 140.52 29.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.592 1.157 . . . . 0.0 108.965 -173.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.462 ' HB3' ' HB2' ' A' ' 52' ' ' MET . . . 74.61 -37.32 0.35 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 170.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -63.53 -29.35 70.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.673 1.189 . . . . 0.0 113.726 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.11 135.88 48.75 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.491 0.717 . . . . 0.0 110.7 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 m -60.84 -33.08 72.5 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -171.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.17 -37.83 75.28 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.193 0.597 . . . . 0.0 109.964 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -72.57 -38.03 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.839 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.5 t -65.19 -34.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 C-N-CA 123.807 0.843 . . . . 0.0 110.328 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.4 t -62.68 -49.13 76.31 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.288 0.635 . . . . 0.0 109.82 178.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 9.1 tp10 -67.33 -41.88 84.53 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.172 0.589 . . . . 0.0 110.513 178.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.56 -44.46 96.99 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.678 1.191 . . . . 0.0 111.147 -177.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.6 p -65.79 -36.17 82.76 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.667 0.787 . . . . 0.0 110.991 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 96.9 mt -63.92 -40.6 96.85 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.913 0.758 . . . . 0.0 111.097 173.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 75.1 mmtt -67.58 -44.04 79.11 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.002 0.521 . . . . 0.0 111.076 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.5 mt -67.32 -35.68 79.91 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.582 0.353 . . . . 0.0 110.172 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -60.69 -39.37 88.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.958 1.303 . . . . 0.0 111.419 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' LEU . 74.2 mmtt -91.64 -68.06 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.926 0.49 . . . . 0.0 110.773 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -63.0 -42.66 99.91 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.249 1.02 . . . . 0.0 112.472 -169.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -98.08 -20.98 17.03 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.147 0.579 . . . . 0.0 111.041 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.89 -7.92 68.42 Favored Glycine 0 C--N 1.353 1.515 0 CA-C-O 119.893 -0.393 . . . . 0.0 113.16 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.449 HG21 HG13 ' A' ' 95' ' ' VAL . 68.9 t -75.75 98.4 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 124.534 1.133 . . . . 0.0 110.021 -175.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.7 m -109.17 154.86 21.76 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.485 1.114 . . . . 0.0 110.271 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.37 20.32 72.32 Favored Glycine 0 C--N 1.351 1.409 0 C-N-CA 123.251 0.453 . . . . 0.0 113.392 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.437 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 m -108.96 16.08 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.639 0.776 . . . . 0.0 110.982 -177.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.48 -56.89 14.96 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.099 1.359 . . . . 0.0 111.292 -175.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.33 -34.97 79.38 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.679 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -68.09 -30.69 69.92 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.636 0.775 . . . . 0.0 110.528 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 96.6 mt -70.4 -39.69 74.34 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.081 0.952 . . . . 0.0 110.96 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.62 -35.41 76.1 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.852 173.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.92 -19.99 53.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.5 0.72 . . . . 0.0 112.19 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.541 HD11 HD13 ' A' ' 94' ' ' LEU . 69.8 mt -67.88 138.65 56.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 117.95 0.341 . . . . 0.0 111.398 176.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -119.54 -38.07 3.05 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 123.364 0.665 . . . . 0.0 109.601 177.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 50.8 p -108.19 148.06 30.46 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 122.119 0.961 . . . . 0.0 112.164 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.452 HG12 ' CE2' ' A' ' 92' ' ' PHE . 34.0 t -65.71 -30.11 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 113.987 -1.46 . . . . 0.0 109.834 176.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.4 -46.49 80.15 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.067 0.947 . . . . 0.0 111.169 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.02 -32.99 74.73 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.264 176.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.98 -48.64 79.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 123.639 0.587 . . . . 0.0 111.902 174.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.452 ' CE2' HG12 ' A' ' 88' ' ' VAL . 64.3 m-85 -56.29 -45.09 80.33 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.235 0.614 . . . . 0.0 110.902 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 48.6 mt-30 -64.52 -49.24 72.07 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.944 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.541 HD13 HD11 ' A' ' 85' ' ' LEU . 8.5 tt -51.72 -57.85 8.08 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.053 1.341 . . . . 0.0 110.378 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.495 HG21 HD21 ' A' ' 31' ' ' LEU . 70.8 t -58.84 -38.75 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.657 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.5 -36.25 78.64 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.17 0.588 . . . . 0.0 111.906 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 34.3 mmtp -66.49 -39.26 88.64 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.214 0.606 . . . . 0.0 110.127 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -78.62 -24.69 45.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.134 0.574 . . . . 0.0 111.208 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -77.62 -32.31 53.37 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.362 0.665 . . . . 0.0 110.64 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.56 -62.12 1.32 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.674 0.79 . . . . 0.0 111.105 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.638 -171.829 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.47 ' O ' HD22 ' A' ' 32' ' ' LEU . 35.5 mt-10 -53.82 -48.63 69.72 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 123.941 0.896 . . . . 0.0 111.122 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.06 -47.05 78.67 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.159 0.912 . . . . 0.0 111.28 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.445 ' O ' HG23 ' A' ' 34' ' ' VAL . 55.4 t60 -73.19 -25.95 60.98 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.619 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.46 -40.02 85.33 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 0.9 OUTLIER -60.89 -40.48 93.22 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.513 0.325 . . . . 0.0 110.202 171.435 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -63.59 -37.99 89.41 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.556 0.742 . . . . 0.0 110.978 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 30' ' ' HIS . 61.1 t -62.61 -50.75 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 122.801 0.441 . . . . 0.0 109.852 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.74 -42.33 95.27 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 122.697 0.399 . . . . 0.0 111.593 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.2 p -64.69 -39.6 93.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.563 0.745 . . . . 0.0 111.96 -174.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.56 -31.33 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.293 175.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.97 -7.71 59.04 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 0.0 112.509 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -112.31 -61.54 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.426 0.69 . . . . 0.0 109.987 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.12 -34.42 2.26 Favored Glycine 0 C--N 1.341 0.84 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.292 -173.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.19 154.87 92.08 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 123.19 0.596 . . . . 0.0 111.1 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -55.23 152.57 30.75 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 123.008 2.472 . . . . 0.0 113.27 168.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.594 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 21.4 ptmt -69.71 -22.81 63.37 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.599 0.76 . . . . 0.0 111.817 -179.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -73.21 -25.4 60.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.336 0.654 . . . . 0.0 110.505 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -72.95 -18.58 61.37 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.446 0.698 . . . . 0.0 111.593 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.0 mt -102.19 124.23 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.312 0.645 . . . . 0.0 109.704 -177.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -133.42 -179.88 5.79 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.297 1.039 . . . . 0.0 108.723 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.497 ' HB3' ' HB2' ' A' ' 89' ' ' ASP . 5.5 mpt_? -58.85 -55.12 39.2 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.004 0.922 . . . . 0.0 111.585 -172.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -90.47 3.92 52.53 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 0.0 112.343 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.5 m -74.48 -0.76 18.55 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 49.7 mtt180 66.81 170.74 0.25 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 112.259 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.75 ' SD ' HD22 ' A' ' 91' ' ' LEU . 72.5 mtm -116.45 29.54 7.89 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.231 1.013 . . . . 0.0 108.973 168.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.98 -55.83 30.11 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.207 0.942 . . . . 0.0 110.795 -172.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -101.72 16.21 26.53 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.972 0.909 . . . . 0.0 110.568 177.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 74.4 mt -114.34 -68.14 0.95 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.842 0.457 . . . . 0.0 111.615 -171.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -112.24 -21.4 11.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -173.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -70.6 89.65 0.73 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.162 0.585 . . . . 0.0 110.32 -176.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -177.62 146.97 0.48 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.616 1.566 . . . . 0.0 108.213 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -56.49 -46.6 80.41 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.386 0.674 . . . . 0.0 112.049 -177.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.41 -37.84 63.24 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.022 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.19 -32.8 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.218 0.324 . . . . 0.0 111.736 -175.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.5 -37.42 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 171.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 70.7 m -67.25 -37.28 83.24 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.013 0.525 . . . . 0.0 111.272 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.43 -37.2 65.94 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.7 tp -66.68 -48.11 70.34 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.494 ' HB3' HD12 ' A' ' 82' ' ' LEU . 40.8 p -66.62 -33.23 75.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.216 0.607 . . . . 0.0 111.665 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 56.2 tp -69.31 -40.4 77.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.348 0.659 . . . . 0.0 110.516 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -71.99 -42.09 66.87 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.392 0.677 . . . . 0.0 110.39 -177.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 93.3 mt -66.57 -38.55 87.31 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.052 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -55.27 -45.08 76.16 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.582 1.153 . . . . 0.0 111.516 177.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.7 -66.51 0.69 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.762 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.94 -54.49 6.5 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.043 -165.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -89.5 -11.68 42.23 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.454 -174.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.57 -7.6 53.03 Favored Glycine 0 C--N 1.355 1.612 0 C-N-CA 123.836 0.731 . . . . 0.0 114.393 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.455 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 48.5 t -77.56 102.79 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.84 0.856 . . . . 0.0 110.777 -171.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 t -137.32 169.36 17.92 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.695 0.798 . . . . 0.0 110.313 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.01 14.62 78.7 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.538 -176.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 35.7 m -119.91 16.17 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.429 1.092 . . . . 0.0 111.274 -173.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -54.94 -44.76 74.58 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.04 0.936 . . . . 0.0 112.216 -173.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -67.07 -34.09 76.92 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.458 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.3 mp0 -67.43 -38.5 84.66 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.668 0.605 . . . . 0.0 110.381 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 66' ' ' SER . 97.7 mt -63.91 -31.47 72.66 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.333 0.653 . . . . 0.0 111.197 178.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -75.1 -35.02 61.8 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.512 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -69.84 -23.46 63.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.631 0.772 . . . . 0.0 111.384 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.602 HD11 HD13 ' A' ' 94' ' ' LEU . 95.1 mt -76.31 118.11 18.68 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 122.938 0.495 . . . . 0.0 110.475 178.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.87 -13.76 19.92 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.682 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -137.55 144.09 41.91 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 124.086 0.954 . . . . 0.0 111.477 -168.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.7 t -75.23 -23.66 17.2 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.06 -171.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.497 ' HB2' ' HB3' ' A' ' 48' ' ' ARG . 31.7 t70 -59.62 -50.06 75.36 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.452 0.644 . . . . 0.0 110.239 178.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -68.02 -31.56 71.32 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.319 -1.31 . . . . 0.0 110.556 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.75 HD22 ' SD ' ' A' ' 52' ' ' MET . 52.5 tp -64.33 -47.29 79.92 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 123.406 0.441 . . . . 0.0 111.586 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -56.73 -45.96 81.64 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.599 0.76 . . . . 0.0 109.881 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.78 -34.06 74.92 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.863 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.602 HD13 HD11 ' A' ' 85' ' ' LEU . 9.4 tt -70.32 -47.03 62.96 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.62 -48.69 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 123.42 0.688 . . . . 0.0 110.057 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.71 -36.34 80.45 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.602 0.761 . . . . 0.0 111.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -64.43 -48.65 74.54 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.306 0.642 . . . . 0.0 110.5 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -77.37 -18.45 57.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.695 0.798 . . . . 0.0 111.499 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -78.44 -46.46 19.73 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.482 0.713 . . . . 0.0 110.282 176.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.51 -62.27 1.58 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.36 0.664 . . . . 0.0 109.901 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.907 179.103 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.45 ' SD ' ' NH1' ' A' ' 99' ' ' ARG . 20.1 ttt . . . . . 0 N--CA 1.501 2.106 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.87 -58.73 6.39 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.121 0.568 . . . . 0.0 110.555 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -62.09 -31.55 72.01 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.17 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.425 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.1 t60 -71.91 -31.68 66.63 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.63 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.3 -37.56 85.69 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.896 0.478 . . . . 0.0 109.713 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -65.09 -35.9 82.61 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.751 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.5 m -66.53 -41.66 88.44 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.238 0.615 . . . . 0.0 110.069 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 30' ' ' HIS . 43.9 t -58.76 -47.04 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.069 0.948 . . . . 0.0 110.294 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' HD23 ' A' ' 55' ' ' LEU . 98.2 mt -68.35 -37.69 80.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.342 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.7 t -64.6 -39.52 93.87 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.085 0.954 . . . . 0.0 111.253 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 65.7 t -78.7 -30.54 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.379 0.672 . . . . 0.0 110.201 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.93 -25.95 53.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.316 0.646 . . . . 0.0 112.156 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.5 p -108.26 -66.11 1.07 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.002 0.521 . . . . 0.0 110.151 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.06 -27.04 2.81 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-O 119.847 -0.418 . . . . 0.0 112.163 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.05 131.66 88.85 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.967 0.507 . . . . 0.0 110.813 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.66 158.82 26.53 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 123.304 2.669 . . . . 0.0 112.478 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -63.12 -21.1 65.96 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.719 0.808 . . . . 0.0 112.51 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -65.83 -26.16 67.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.765 0.826 . . . . 0.0 111.335 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -100.29 8.27 43.84 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.885 0.874 . . . . 0.0 111.914 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 HD21 ' A' ' 55' ' ' LEU . 38.4 mt -113.14 140.08 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.188 0.595 . . . . 0.0 109.876 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -151.55 173.33 14.75 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.517 1.127 . . . . 0.0 109.366 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -30.25 69.92 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.463 0.649 . . . . 0.0 110.0 169.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.39 15.58 10.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.526 1.13 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.486 ' HB3' HG21 ' A' ' 88' ' ' VAL . 47.9 t -70.22 -21.38 63.02 Favored 'General case' 0 C--N 1.358 0.976 0 O-C-N 122.052 -0.405 . . . . 0.0 110.452 171.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 56.45 23.18 7.19 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.834 1.253 . . . . 0.0 113.404 169.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.638 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 14.3 mmt 60.4 54.58 3.82 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.195 0.998 . . . . 0.0 111.928 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 50' ' ' SER . 20.0 mm-40 -68.8 -71.31 0.22 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.179 0.514 . . . . 0.0 110.208 177.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.03 -19.99 14.01 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.915 1.286 . . . . 0.0 109.837 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 35' ' ' LEU . 4.4 mp -93.15 133.12 36.65 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.21 1.004 . . . . 0.0 110.357 -168.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.638 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 68.38 -69.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.861 1.664 . . . . 0.0 112.051 176.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.578 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 43.9 t80 -56.79 90.84 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.342 1.457 . . . . 0.0 111.776 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.1 t70 176.14 146.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 106.513 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 56.2 p -56.84 -45.48 82.34 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.054 0.542 . . . . 0.0 112.271 -175.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.6 tp -70.37 -49.08 52.92 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.279 0.632 . . . . 0.0 110.867 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 18.5 t -71.53 -26.45 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 123.43 0.457 . . . . 0.0 111.322 -172.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.91 -43.96 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.506 0.722 . . . . 0.0 109.646 172.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.1 m -62.27 -36.5 82.25 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.468 0.651 . . . . 0.0 111.122 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 25.6 tt0 -75.22 -37.84 60.93 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.306 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 35.1 tp -65.47 -28.45 69.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.319 0.648 . . . . 0.0 110.673 176.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 58.2 m -63.07 -49.48 74.36 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.097 0.959 . . . . 0.0 110.553 175.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -75.19 -19.94 59.56 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 119.217 -0.421 . . . . 0.0 112.126 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.551 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 72.9 mmtt -64.43 -62.88 1.32 Allowed 'General case' 0 C--N 1.367 1.365 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.63 -30.46 69.88 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.524 1.129 . . . . 0.0 111.802 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -52.9 -49.24 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.913 1.285 . . . . 0.0 110.451 173.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -91.42 -24.5 19.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.52 0.728 . . . . 0.0 111.722 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -85.64 -52.98 5.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.821 0.848 . . . . 0.0 111.571 -166.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -117.58 -2.19 11.52 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.365 0.666 . . . . 0.0 110.848 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.5 -3.88 83.56 Favored Glycine 0 C--N 1.353 1.515 0 C-N-CA 122.992 0.329 . . . . 0.0 113.409 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.411 HG12 HG22 ' A' ' 78' ' ' VAL . 13.0 t -89.36 98.44 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.8 t -80.17 143.66 33.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.177 0.591 . . . . 0.0 112.336 -169.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.32 -87.22 0.5 Allowed Glycine 0 C--N 1.351 1.377 0 O-C-N 124.287 0.992 . . . . 0.0 112.872 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.584 HG12 ' HB3' ' A' ' 81' ' ' GLU . 3.5 t 62.3 21.93 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 C-N-CA 124.518 1.127 . . . . 0.0 110.032 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.07 -41.22 74.77 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.814 1.246 . . . . 0.0 112.663 -168.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -62.08 -44.87 95.73 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 123.875 0.734 . . . . 0.0 111.009 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.584 ' HB3' HG12 ' A' ' 78' ' ' VAL . 8.4 tp10 -72.61 -47.88 44.15 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.186 -175.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.87 -30.61 70.98 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.971 0.908 . . . . 0.0 111.475 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.76 -44.89 80.21 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.508 0.723 . . . . 0.0 110.476 171.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -71.57 -27.75 63.37 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.901 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 80.0 mt -66.67 111.98 3.95 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.384 0.611 . . . . 0.0 110.791 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -100.52 -22.07 15.12 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.285 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.96 149.22 50.43 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.377 0.671 . . . . 0.0 111.286 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.486 HG21 ' HB3' ' A' ' 50' ' ' SER . 45.0 t -66.0 -28.42 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.218 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 17.7 t70 -60.04 -41.46 92.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 122.761 0.424 . . . . 0.0 110.559 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.44 -29.9 69.49 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.23 0.612 . . . . 0.0 111.625 175.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 69.3 tp -64.74 -39.37 93.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.557 0.343 . . . . 0.0 110.623 171.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.72 -41.07 98.14 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.773 0.429 . . . . 0.0 110.522 174.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 73.6 mm-40 -62.45 -42.13 99.24 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.817 0.447 . . . . 0.0 110.509 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.582 HD13 ' HG2' ' A' ' 81' ' ' GLU . 42.3 tp -59.65 -61.01 2.94 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.057 0.943 . . . . 0.0 110.897 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 87.7 t -64.44 -40.75 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.151 0.581 . . . . 0.0 111.099 -172.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.02 -53.57 24.91 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.52 0.728 . . . . 0.0 110.246 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -66.51 -36.07 81.8 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.396 0.678 . . . . 0.0 111.707 -174.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 -84.7 -22.53 29.73 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.45 ' NH1' ' SD ' ' A' ' 27' ' ' MET . 46.5 ttt180 -74.62 -37.85 62.71 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.46 -51.88 52.1 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.791 0.837 . . . . 0.0 110.244 172.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 126.464 1.906 . . . . 0.0 112.118 -178.872 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.5 tmm? . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.19 -61.83 2.1 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 124.054 0.846 . . . . 0.0 111.721 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 30.5 t70 -69.85 -24.69 63.48 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.881 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -65.77 -33.45 75.9 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.429 0.692 . . . . 0.0 110.477 170.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 91' ' ' LEU . 10.4 tt -68.8 -37.05 78.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.071 0.548 . . . . 0.0 110.079 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.566 HD23 ' HA ' ' A' ' 29' ' ' ASP . 2.6 mm? -62.77 -34.98 78.38 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 123.03 0.206 . . . . 0.0 111.144 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 37' ' ' VAL . 11.9 m -63.22 -42.22 99.24 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.457 0.703 . . . . 0.0 110.609 176.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.526 HG13 ' HG2' ' A' ' 68' ' ' LYS . 41.4 t -63.82 -43.07 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.38 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.02 -39.44 93.4 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.049 0.54 . . . . 0.0 111.484 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.5 p -68.15 -31.56 71.22 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.484 0.49 . . . . 0.0 111.682 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 33' ' ' THR . 87.8 t -75.04 -39.87 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.058 0 C-N-CA 122.876 0.47 . . . . 0.0 110.155 174.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.58 -29.94 62.71 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.649 0.78 . . . . 0.0 112.244 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.6 p -94.42 -53.78 3.78 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.192 0.597 . . . . 0.0 110.147 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.55 -15.04 9.89 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.951 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.8 m -92.67 145.72 30.9 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.363 0.665 . . . . 0.0 110.523 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -51.25 158.16 3.83 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.836 3.024 . . . . 0.0 115.162 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -63.35 -22.83 67.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.473 1.109 . . . . 0.0 111.984 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.42 -29.21 68.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.785 0.434 . . . . 0.0 111.147 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.62 0.56 56.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.601 0.761 . . . . 0.0 111.0 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.469 HG22 HD12 ' A' ' 32' ' ' LEU . 34.9 mt -129.82 105.96 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 123.674 0.789 . . . . 0.0 110.751 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.8 t -110.72 -177.77 3.31 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.737 0.815 . . . . 0.0 109.172 170.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.9 ptp85 -67.11 -33.36 75.3 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 173.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -70.43 -19.48 62.98 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.235 1.014 . . . . 0.0 111.3 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 m -66.44 149.23 50.73 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.873 0.844 . . . . 0.0 111.499 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.569 ' HD3' HG22 ' A' ' 87' ' ' THR . 16.4 mmt180 -82.98 -161.45 0.49 Allowed 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.183 178.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 49.5 mtt -130.99 -2.61 4.04 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.94 -10.92 23.98 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 118.833 0.742 . . . . 0.0 112.698 -173.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -141.88 26.57 1.88 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.746 0.818 . . . . 0.0 109.675 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 72.5 mt -136.35 -32.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.701 0.8 . . . . 0.0 112.616 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.51 -41.32 0.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 122.797 0.439 . . . . 0.0 112.0 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -61.28 87.78 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.925 1.29 . . . . 0.0 111.242 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 175.38 133.12 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.238 1.815 . . . . 0.0 106.307 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.3 m -52.29 -38.22 57.75 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 119.026 0.83 . . . . 0.0 113.17 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.04 -41.23 62.12 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.472 0.709 . . . . 0.0 111.141 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.9 t -76.98 -24.84 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 122.317 0.247 . . . . 0.0 110.627 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.0 -39.95 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 171.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.2 t -62.92 -43.61 98.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.631 0.772 . . . . 0.0 111.009 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -72.53 -38.36 68.05 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.567 0.747 . . . . 0.0 111.376 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.14 -46.09 75.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.291 0.636 . . . . 0.0 109.795 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.7 t -63.37 -31.8 73.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.123 0.969 . . . . 0.0 111.258 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.66 -46.57 87.61 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.526 ' HG2' HG13 ' A' ' 34' ' ' VAL . 0.1 OUTLIER -71.67 -35.88 70.45 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.461 -177.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.53 -42.55 78.33 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.847 0.459 . . . . 0.0 110.011 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 76' ' ' THR . 2.0 tmt_? -64.56 -48.22 75.83 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.302 1.041 . . . . 0.0 110.221 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -82.31 -67.13 0.81 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.312 -175.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -77.77 -47.73 18.28 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.84 -164.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.464 ' CE1' HG21 ' A' ' 34' ' ' VAL . 80.2 m-85 -79.53 -24.43 42.2 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.047 0.539 . . . . 0.0 110.982 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.0 -5.22 83.64 Favored Glycine 0 C--N 1.349 1.287 0 O-C-N 123.279 0.362 . . . . 0.0 113.369 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 HG21 ' A' ' 78' ' ' VAL . 40.7 t -81.9 87.92 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.271 1.029 . . . . 0.0 108.681 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 45.8 p -71.16 134.63 47.1 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.963 -168.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.62 -110.24 3.02 Favored Glycine 0 C--N 1.348 1.227 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.291 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG11 HD21 ' A' ' 94' ' ' LEU . 10.2 t 69.46 8.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 125.571 1.549 . . . . 0.0 110.823 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -48.61 -41.78 32.01 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.387 1.475 . . . . 0.0 113.146 -168.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.52 -46.91 71.48 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.365 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -73.91 -25.0 59.77 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.69 0.396 . . . . 0.0 110.838 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.15 -32.62 70.67 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.978 0.911 . . . . 0.0 110.418 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -68.21 -36.29 79.32 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.072 171.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.91 -1.75 36.66 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.542 0.737 . . . . 0.0 112.589 177.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.495 HD11 HD13 ' A' ' 94' ' ' LEU . 65.7 mt -80.76 151.81 28.62 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.284 0.493 . . . . 0.0 111.599 176.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -132.45 -44.81 0.91 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 109.361 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.569 HG22 ' HD3' ' A' ' 51' ' ' ARG . 64.1 p -117.4 156.4 27.98 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.443 0.697 . . . . 0.0 110.852 -177.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 90.6 t -67.9 -33.16 59.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.15 174.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.22 -38.96 81.24 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.089 0.956 . . . . 0.0 110.589 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.07 -31.88 66.52 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.147 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 31' ' ' LEU . 44.1 tp -67.39 -33.9 76.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.124 0.57 . . . . 0.0 110.874 173.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -68.32 -38.96 82.08 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.93 0.492 . . . . 0.0 110.945 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -69.01 -29.18 67.31 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 175.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.495 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -65.24 -59.52 3.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.648 0.779 . . . . 0.0 109.31 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 86.0 t -58.67 -30.88 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.004 0.922 . . . . 0.0 111.076 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.98 -52.84 63.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.12 0.968 . . . . 0.0 111.097 175.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -68.9 -30.05 68.45 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.533 0.733 . . . . 0.0 111.331 -177.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -83.14 -17.46 42.92 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.699 0.8 . . . . 0.0 111.612 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -83.22 -33.76 26.04 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.77 -35.59 72.68 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.718 0.807 . . . . 0.0 110.631 177.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.563 0 C-N-CA 124.4 1.08 . . . . 0.0 108.126 175.597 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 19.7 ttt . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -61.67 -57.73 10.82 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.222 1.009 . . . . 0.0 112.784 -167.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.65 -43.09 99.51 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.558 0.536 . . . . 0.0 110.679 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -67.2 -32.0 72.77 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.048 0.842 . . . . 0.0 111.308 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 24.1 tp -64.83 -45.06 87.72 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.36 -31.24 72.26 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.202 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.3 m -67.66 -42.13 82.67 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.829 0.452 . . . . 0.0 109.939 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' HG3' ' A' ' 68' ' ' LYS . 22.3 t -60.84 -44.57 97.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.352 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 53.6 mt -67.94 -32.18 72.45 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.693 0.62 . . . . 0.0 110.908 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.3 t -64.84 -35.94 82.73 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.857 0.723 . . . . 0.0 111.072 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.2 t -82.92 -25.55 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.898 0.879 . . . . 0.0 110.68 178.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -82.91 -27.56 30.55 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.463 0.705 . . . . 0.0 111.904 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.1 p -107.07 -55.28 2.35 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.056 0.542 . . . . 0.0 110.544 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 130.86 -29.84 3.48 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.47 -178.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 m -79.03 140.9 57.91 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.685 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.515 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 37.7 Cg_endo -63.86 170.53 8.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.108 2.539 . . . . 0.0 113.323 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.21 -22.11 66.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.074 0.95 . . . . 0.0 111.705 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.68 -29.38 66.8 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.105 0.562 . . . . 0.0 110.835 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 11.4 mm-40 -92.5 6.33 47.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.346 0.658 . . . . 0.0 110.755 176.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -127.22 99.23 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.1 0.96 . . . . 0.0 108.821 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.495 ' OG ' ' HB2' ' A' ' 50' ' ' SER . 57.8 p -98.68 150.64 21.57 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -66.68 -24.29 66.25 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.9 0.88 . . . . 0.0 112.2 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -99.68 1.2 43.25 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.912 0.885 . . . . 0.0 111.18 -175.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.495 ' HB2' ' OG ' ' A' ' 47' ' ' SER . 9.0 t -83.35 170.21 14.81 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 123.438 0.695 . . . . 0.0 111.921 -176.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -67.68 147.65 52.38 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.149 165.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.652 ' HG3' ' HB2' ' A' ' 55' ' ' LEU . 19.8 ttt -102.29 -77.73 0.55 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.296 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 38.07 -80.07 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 113.896 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.12 -30.02 64.03 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.052 0.541 . . . . 0.0 112.218 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.652 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 51.1 mt -70.75 -25.5 62.94 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.448 0.699 . . . . 0.0 112.345 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -170.35 96.6 0.25 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.067 0.947 . . . . 0.0 110.766 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -168.07 49.19 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 177.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.402 ' O ' HG23 ' A' ' 62' ' ' VAL . 10.5 t70 -161.94 134.81 6.02 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.986 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.6 p -47.71 -46.7 29.87 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.647 1.179 . . . . 0.0 113.377 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.34 -39.81 74.47 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.588 0.355 . . . . 0.0 110.789 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.31 -34.86 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 123.254 0.347 . . . . 0.0 110.666 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.54 HG13 ' HB2' ' A' ' 82' ' ' LEU . 75.0 t -69.51 -39.06 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.914 0.885 . . . . 0.0 110.203 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.3 m -64.47 -44.58 90.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.402 0.681 . . . . 0.0 110.09 175.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -64.89 -44.84 88.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.28 1.032 . . . . 0.0 110.819 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.0 tp -69.21 -38.7 78.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.036 0.934 . . . . 0.0 110.407 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.0 t -61.13 -38.66 87.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.471 0.709 . . . . 0.0 110.68 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.497 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 94.0 mt -63.55 -48.75 76.21 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.875 0.735 . . . . 0.0 110.625 175.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.506 ' HG3' HG13 ' A' ' 34' ' ' VAL . 75.3 mmtt -59.72 -47.77 84.34 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.093 0.557 . . . . 0.0 111.196 -178.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.58 -29.78 69.22 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.516 0.727 . . . . 0.0 111.347 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.69 -53.06 37.63 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.197 0.999 . . . . 0.0 111.115 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 4.0 mptp? -72.4 -41.54 66.16 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.557 -177.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -82.2 -53.99 5.62 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.303 0.641 . . . . 0.0 112.175 -170.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -107.14 -14.77 14.83 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.157 0.583 . . . . 0.0 112.063 -171.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.28 -6.14 77.46 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 122.908 0.29 . . . . 0.0 112.885 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.577 HG12 HG21 ' A' ' 78' ' ' VAL . 46.0 t -80.93 80.12 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.082 0.953 . . . . 0.0 109.821 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 t -91.32 160.75 15.34 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.28 0.632 . . . . 0.0 111.251 -174.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.49 -110.97 3.15 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.577 HG21 HG12 ' A' ' 75' ' ' VAL . 3.4 t 58.15 26.19 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 125.231 1.412 . . . . 0.0 111.1 173.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -51.37 -57.67 8.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.25 1.42 . . . . 0.0 112.987 -166.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-20 -60.0 -43.49 95.17 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.071 0.857 . . . . 0.0 110.88 -176.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HB2' HG12 ' A' ' 78' ' ' VAL . 38.4 mt-10 -69.77 -40.95 75.77 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.036 0.535 . . . . 0.0 111.105 -173.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.54 ' HB2' HG13 ' A' ' 62' ' ' VAL . 76.6 mt -69.95 -25.16 63.51 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.948 0.499 . . . . 0.0 111.177 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.79 -16.51 31.93 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.181 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 0.3 OUTLIER -99.31 10.31 41.67 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.802 0.841 . . . . 0.0 110.052 -177.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.477 HD11 HD13 ' A' ' 91' ' ' LEU . 24.7 mt -69.29 115.46 8.58 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -173.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -91.23 -53.41 4.37 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.07 -178.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.5 p -127.04 158.41 37.03 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.795 0.838 . . . . 0.0 110.714 -177.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -66.06 -38.55 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -56.46 -34.23 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.328 1.051 . . . . 0.0 111.533 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.2 -40.62 86.49 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.264 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.477 HD13 HD11 ' A' ' 85' ' ' LEU . 63.4 tp -64.1 -34.46 78.08 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 123.673 0.608 . . . . 0.0 111.472 176.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -59.99 -52.53 65.01 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.798 0.439 . . . . 0.0 110.733 174.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -71.72 -19.29 62.07 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.792 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.545 HD21 HG11 ' A' ' 78' ' ' VAL . 8.2 tt -71.74 -57.69 4.14 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.706 0.802 . . . . 0.0 109.106 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.91 -31.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.325 0.65 . . . . 0.0 110.101 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -70.61 -37.71 73.87 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.631 0.773 . . . . 0.0 109.684 174.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.992 0.517 . . . . 0.0 109.822 177.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -72.9 -32.42 65.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.748 0.819 . . . . 0.0 111.25 176.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -66.09 -44.89 83.08 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.614 0.766 . . . . 0.0 110.096 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.58 64.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.286 1.034 . . . . 0.0 110.535 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.74 0 C-N-CA 123.481 0.712 . . . . 0.0 111.144 175.251 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.652 0.263 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.427 ' HG2' ' CE1' ' A' ' 92' ' ' PHE . 9.2 tm-20 -62.37 -39.92 94.76 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.879 0.872 . . . . 0.0 109.857 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -59.16 -50.78 72.73 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.225 0.61 . . . . 0.0 111.119 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 34' ' ' VAL . 34.8 m-70 -64.74 -36.47 84.4 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.267 0.627 . . . . 0.0 110.886 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.48 -37.41 74.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.76 -28.66 63.79 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.997 0.919 . . . . 0.0 110.187 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.6 m -71.98 -42.65 66.26 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.278 1.031 . . . . 0.0 109.952 174.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 30' ' ' HIS . 37.1 t -55.3 -46.14 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 123.567 0.747 . . . . 0.0 109.966 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.403 HD21 HD23 ' A' ' 91' ' ' LEU . 94.7 mt -62.14 -43.49 98.71 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.042 176.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.4 t -65.07 -34.83 79.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.033 0.933 . . . . 0.0 111.892 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.02 -37.45 17.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.481 0.712 . . . . 0.0 109.984 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.85 -26.83 59.97 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.649 0.78 . . . . 0.0 111.861 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.401 ' OG ' HG22 ' A' ' 41' ' ' VAL . 83.8 p -96.46 -41.57 8.52 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.625 0.77 . . . . 0.0 110.68 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.65 -15.11 62.42 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.374 -173.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.401 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -86.76 147.05 42.56 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 123.16 0.584 . . . . 0.0 110.342 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -52.78 155.52 10.59 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.128 2.552 . . . . 0.0 113.956 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -63.57 -26.17 68.57 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.292 0.637 . . . . 0.0 111.139 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.01 -31.14 71.49 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.794 0.838 . . . . 0.0 111.413 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.57 -30.44 64.4 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.511 0.724 . . . . 0.0 110.537 176.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -89.67 97.12 6.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.889 -174.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -79.58 156.92 27.48 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 167.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.401 ' O ' HG23 ' A' ' 88' ' ' VAL . 3.0 mpt_? -68.49 -30.28 69.07 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.22 87.04 6.35 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.2 t -142.83 142.57 31.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.708 0.803 . . . . 0.0 108.898 172.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -85.86 18.24 3.05 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.011 0.924 . . . . 0.0 112.013 -176.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 49.1 mtt 60.72 24.45 14.29 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 124.287 1.035 . . . . 0.0 112.188 176.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -32.92 -58.61 0.36 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 126.286 1.834 . . . . 0.0 113.497 -169.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.72 9.75 4.64 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.389 -0.823 . . . . 0.0 108.901 172.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.03 -42.4 17.53 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.701 0.8 . . . . 0.0 112.028 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -150.5 -1.94 0.38 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -86.31 76.56 9.66 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -179.8 136.3 0.12 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.275 1.43 . . . . 0.0 108.32 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.2 p -58.23 -36.84 73.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.134 0.974 . . . . 0.0 113.144 -173.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.39 -38.37 74.68 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.9 t -71.58 -31.13 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.413 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 66.7 t -69.33 -34.58 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.693 0.797 . . . . 0.0 110.168 174.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.6 t -73.76 -33.72 64.4 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.192 0.597 . . . . 0.0 110.585 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.7 -39.91 84.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.354 0.661 . . . . 0.0 109.538 173.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD11 HD21 ' A' ' 91' ' ' LEU . 59.3 tp -63.22 -51.87 64.5 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.62 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 62.0 p -62.63 -36.32 82.43 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.874 0.87 . . . . 0.0 111.376 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.9 tp -64.95 -41.72 95.25 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.741 0.65 . . . . 0.0 110.854 175.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -69.09 -35.94 77.04 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.289 0.635 . . . . 0.0 111.271 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 88.2 mt -67.75 -32.9 73.82 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.911 0.485 . . . . 0.0 110.038 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -30.88 71.9 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.768 1.227 . . . . 0.0 111.289 175.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -93.59 -61.77 1.49 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.089 0.555 . . . . 0.0 111.335 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -61.6 -47.76 84.0 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.701 1.2 . . . . 0.0 112.063 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -108.64 -18.88 13.61 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 -172.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.2 -13.41 54.92 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-O 120.095 -0.281 . . . . 0.0 113.25 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.61 100.57 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.764 0.826 . . . . 0.0 109.206 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 39.7 m -90.78 141.38 28.87 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.836 0.854 . . . . 0.0 111.794 -169.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.39 -107.72 2.68 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.819 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 81' ' ' GLU . 3.7 t 64.55 15.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.94 1.296 . . . . 0.0 110.883 177.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.64 -28.39 67.19 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.578 1.151 . . . . 0.0 113.457 -166.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -63.27 -51.36 66.47 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 123.68 0.613 . . . . 0.0 110.281 175.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HB2' HG12 ' A' ' 78' ' ' VAL . 4.4 mp0 -68.9 -31.94 71.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.154 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.1 mt -73.17 -18.03 61.31 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -78.34 -35.86 47.02 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.434 0.694 . . . . 0.0 109.596 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.79 2.1 10.95 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.561 0.744 . . . . 0.0 112.499 176.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.625 HD11 HD13 ' A' ' 91' ' ' LEU . 38.8 mt -70.05 140.72 52.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.024 0.529 . . . . 0.0 112.007 172.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.41 -51.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.416 0 O-C-N 124.509 1.131 . . . . 0.0 108.206 170.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.7 p -102.87 149.07 24.87 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.129 0.572 . . . . 0.0 110.679 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 48' ' ' ARG . 4.0 m -67.38 -26.73 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.615 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.52 -45.55 77.11 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.817 . . . . 0.0 110.528 169.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.86 -40.8 85.4 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-N 114.854 -1.067 . . . . 0.0 109.877 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.625 HD13 HD11 ' A' ' 85' ' ' LEU . 47.0 tp -65.87 -39.26 90.53 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.659 0.783 . . . . 0.0 112.425 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CE1' ' HG2' ' A' ' 28' ' ' GLU . 60.4 m-85 -62.06 -36.99 83.32 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.585 ' HA ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -82.95 -23.13 33.57 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.706 0.802 . . . . 0.0 112.271 178.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 tt -74.45 -55.37 6.04 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.55 -37.28 74.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.032 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.52 -45.75 84.63 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 123.948 0.78 . . . . 0.0 111.233 173.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -57.85 -48.47 79.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.922 0.889 . . . . 0.0 111.072 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -82.25 -33.83 29.07 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.621 -174.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.08 -42.07 48.49 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.57 -54.07 49.91 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.166 0.587 . . . . 0.0 110.28 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 C-N-CA 124.773 1.229 . . . . 0.0 113.304 173.923 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 ttp . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 119.931 -0.081 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.99 -61.93 1.68 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.899 0.88 . . . . 0.0 112.069 -171.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -65.2 -30.92 71.86 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.704 0.802 . . . . 0.0 110.478 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -63.17 -41.1 99.17 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.741 0.817 . . . . 0.0 109.584 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.506 HD21 ' HG ' ' A' ' 91' ' ' LEU . 39.2 tp -66.69 -38.92 87.75 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.184 0.994 . . . . 0.0 110.003 177.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.5 tp -62.23 -38.74 90.38 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.489 1.116 . . . . 0.0 110.777 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.3 m -66.56 -42.37 87.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.114 0.966 . . . . 0.0 110.684 176.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -57.87 -45.88 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.697 0.799 . . . . 0.0 110.861 177.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 83.5 mt -63.04 -37.94 89.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.519 0.728 . . . . 0.0 111.133 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -61.89 -37.98 86.63 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.509 0.724 . . . . 0.0 111.242 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 56.7 t -79.72 -32.91 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.506 0.723 . . . . 0.0 110.539 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.19 -14.07 58.74 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.757 0.823 . . . . 0.0 111.914 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.463 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 18.4 m -112.24 -38.86 4.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.256 0.622 . . . . 0.0 110.847 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.7 -30.28 10.58 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.008 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.62 137.84 88.33 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.289 0.635 . . . . 0.0 110.364 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.71 161.44 10.06 Favored 'Trans proline' 0 C--N 1.379 2.138 0 C-N-CA 123.46 2.773 . . . . 0.0 113.802 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.92 -29.42 70.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.713 0.805 . . . . 0.0 111.214 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.53 -18.22 64.32 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 111.609 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -89.49 -20.08 24.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.415 0.686 . . . . 0.0 111.175 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.4 mt -102.43 105.04 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.975 0.51 . . . . 0.0 110.892 -174.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.9 p -95.27 -178.02 4.31 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 165.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.73 ' HA ' ' HB ' ' A' ' 88' ' ' VAL . 11.0 ptp180 -84.73 -11.53 55.64 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.596 -0.69 . . . . 0.0 111.25 175.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.99 13.45 28.91 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.607 0.763 . . . . 0.0 110.456 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -85.02 18.34 2.54 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.259 0.624 . . . . 0.0 112.577 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.4 ' O ' HD12 ' A' ' 55' ' ' LEU . 3.8 mmm180 68.12 167.01 0.25 Allowed 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.145 175.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.507 ' HG3' ' HB3' ' A' ' 85' ' ' LEU . 87.9 mmm -121.53 94.47 4.33 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 170.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -137.92 -65.66 0.51 Allowed 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -83.43 -35.14 25.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.245 176.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 70.1 mt -69.69 -44.11 71.1 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.257 -172.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.92 94.95 0.08 Allowed 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.512 1.133 . . . . 0.0 109.68 169.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -163.64 -37.66 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.088 0.955 . . . . 0.0 108.496 175.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -53.98 139.53 34.05 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.046 0.841 . . . . 0.0 110.041 168.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -47.73 -47.29 30.24 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.103 1.361 . . . . 0.0 113.183 -173.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.3 mt -80.36 -25.83 38.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.872 -174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.1 t -77.29 -29.24 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 123.174 0.296 . . . . 0.0 110.207 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.4 t -70.14 -44.68 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.619 0.768 . . . . 0.0 109.897 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.8 p -67.76 -33.58 75.13 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.548 0.53 . . . . 0.0 110.777 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.63 -47.65 74.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.758 0.823 . . . . 0.0 110.422 175.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.8 tp -68.89 -40.48 79.18 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 -174.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 66.5 m -62.6 -48.38 79.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.978 0.511 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.3 tp -57.05 -36.23 70.26 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.865 0.728 . . . . 0.0 110.483 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.0 tppt? -68.61 -52.93 26.11 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.368 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 83.6 mt -52.01 -44.11 63.99 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.11 0.964 . . . . 0.0 111.532 -175.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -61.06 -36.93 80.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.472 1.109 . . . . 0.0 111.92 -174.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -97.92 -64.87 1.0 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.964 0.506 . . . . 0.0 110.905 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.86 -40.62 63.58 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.704 1.602 . . . . 0.0 113.24 -173.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -120.57 -14.79 8.59 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -171.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.85 16.42 79.34 Favored Glycine 0 CA--C 1.534 1.249 0 N-CA-C 113.862 0.305 . . . . 0.0 113.862 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.612 HG21 HG13 ' A' ' 95' ' ' VAL . 59.1 t -93.87 136.16 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 123.86 0.864 . . . . 0.0 108.854 176.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -67.37 156.99 35.13 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 122.736 0.415 . . . . 0.0 111.4 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.16 88.28 0.15 Allowed Glycine 0 C--N 1.357 1.699 0 O-C-N 123.41 0.444 . . . . 0.0 112.994 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.6 m -94.14 47.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.312 1.045 . . . . 0.0 111.226 -174.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -48.12 -39.85 21.76 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.409 1.484 . . . . 0.0 113.963 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.99 -52.45 65.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.335 1.054 . . . . 0.0 110.085 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.11 -25.71 61.85 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -176.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.23 -31.09 70.34 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.856 0.463 . . . . 0.0 110.85 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.53 -26.45 45.75 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.776 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -90.21 12.97 16.42 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.908 0.483 . . . . 0.0 112.22 176.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.528 HD21 HD22 ' A' ' 94' ' ' LEU . 94.1 mt -80.09 148.42 31.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.665 0.386 . . . . 0.0 110.63 172.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -115.47 -55.88 2.4 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.587 0.755 . . . . 0.0 109.858 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.3 p -119.44 163.61 16.99 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.896 0.879 . . . . 0.0 109.637 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 48' ' ' ARG . 11.0 t -69.63 -23.25 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 30.6 t70 -57.12 -48.45 78.62 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.372 0.669 . . . . 0.0 109.739 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -55.75 -39.21 70.85 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.085 0.866 . . . . 0.0 111.265 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.506 ' HG ' HD21 ' A' ' 31' ' ' LEU . 44.4 tp -63.42 -48.45 77.74 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 123.707 0.63 . . . . 0.0 111.601 176.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -60.46 -34.75 74.46 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.363 0.665 . . . . 0.0 110.932 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 16.7 mm100 -75.91 -36.68 59.34 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.608 0.567 . . . . 0.0 110.501 177.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.528 HD22 HD21 ' A' ' 85' ' ' LEU . 26.7 tp -61.2 -53.47 56.46 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.448 0.699 . . . . 0.0 109.748 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.612 HG13 HG21 ' A' ' 75' ' ' VAL . 84.7 t -61.8 -34.73 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.659 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.43 -62.53 1.78 Allowed 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.607 0.763 . . . . 0.0 111.476 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -38.66 90.42 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.881 0.473 . . . . 0.0 111.66 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -74.44 -25.27 59.32 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.308 0.643 . . . . 0.0 112.713 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -88.28 -35.25 17.35 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.549 0.34 . . . . 0.0 110.319 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.93 -31.17 66.08 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.447 0.699 . . . . 0.0 110.77 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.166 0 C-N-CA 124.885 1.274 . . . . 0.0 111.7 -179.108 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.532 ' SD ' HD13 ' A' ' 31' ' ' LEU . 19.4 tmm? . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -59.1 -49.83 76.39 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.066 0.546 . . . . 0.0 110.831 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -49.72 -40.53 40.95 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.345 1.058 . . . . 0.0 111.536 171.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.12 -38.47 69.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.613 0.765 . . . . 0.0 111.287 -173.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.532 HD13 ' SD ' ' A' ' 27' ' ' MET . 11.1 mp -69.75 -33.29 72.23 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 117.973 0.351 . . . . 0.0 110.758 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.34 -33.9 77.06 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.428 0.455 . . . . 0.0 110.41 172.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.9 m -71.88 -39.82 69.36 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.214 0.605 . . . . 0.0 110.337 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.0 t -58.51 -49.63 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.797 0.839 . . . . 0.0 110.042 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.25 -28.3 66.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.628 0.771 . . . . 0.0 111.556 177.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 29.9 t -66.1 -38.17 87.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.842 0.457 . . . . 0.0 111.015 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.2 t -87.17 -30.12 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.09 47.82 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.233 0.613 . . . . 0.0 112.032 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.2 m -108.62 -26.0 10.6 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.184 0.594 . . . . 0.0 111.495 -175.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.49 -27.48 19.35 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-O 119.997 -0.335 . . . . 0.0 112.83 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' SER . 36.0 m -73.0 141.11 81.21 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 123.16 0.584 . . . . 0.0 110.214 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.42 165.63 29.92 Favored 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 122.354 2.036 . . . . 0.0 112.163 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -60.86 -23.31 65.05 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.907 0.883 . . . . 0.0 111.999 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.41 -29.18 65.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.197 0.999 . . . . 0.0 110.887 -176.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -79.66 -11.08 59.87 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.732 0.813 . . . . 0.0 111.343 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.0 mt -110.24 146.78 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.852 0.861 . . . . 0.0 109.743 -174.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.8 p -145.27 157.21 44.11 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 171.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -66.08 -22.51 66.41 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 117.759 0.254 . . . . 0.0 111.145 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -112.07 92.63 4.1 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 171.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -159.34 160.99 35.69 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.317 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmm180 -84.66 129.65 34.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.875 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.418 ' HE3' ' HA ' ' A' ' 88' ' ' VAL . 28.0 mtt -88.58 56.12 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.069 0.948 . . . . 0.0 110.116 174.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.432 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 21.4 mm-40 -71.13 -16.85 62.58 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.827 175.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.92 -30.27 0.53 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.267 1.027 . . . . 0.0 110.737 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -73.79 -10.05 59.27 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.95 33.03 0.15 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.793 0.837 . . . . 0.0 109.311 172.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -99.15 -62.1 1.28 Allowed 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.053 -171.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.501 ' HB3' HG23 ' A' ' 61' ' ' VAL . 34.5 t70 -66.8 152.62 45.19 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.991 0.516 . . . . 0.0 111.704 -176.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 m -52.8 -42.71 65.34 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.107 1.363 . . . . 0.0 112.656 -178.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -67.03 -42.23 85.23 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.834 0.709 . . . . 0.0 110.493 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.501 HG23 ' HB3' ' A' ' 58' ' ' ASP . 21.7 t -64.46 -41.86 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 O-C-N 123.693 0.621 . . . . 0.0 110.482 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.8 t -66.53 -38.95 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.977 0.911 . . . . 0.0 110.503 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.6 t -66.81 -42.38 86.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.726 0.81 . . . . 0.0 110.938 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 41.0 mt-10 -74.48 -33.06 62.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.836 0.854 . . . . 0.0 110.588 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.7 tp -65.19 -41.16 94.82 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.018 0.927 . . . . 0.0 109.734 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.8 t -62.73 -46.42 88.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.118 0.967 . . . . 0.0 110.88 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.79 -30.69 70.95 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.068 -176.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 44.8 mmtm -71.11 -59.71 2.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.783 0.433 . . . . 0.0 110.776 175.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 91' ' ' LEU . 95.9 mt -60.71 -27.6 68.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.526 0.73 . . . . 0.0 112.242 -174.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.14 -56.13 18.74 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.657 1.183 . . . . 0.0 109.683 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -81.47 -40.56 23.09 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.098 -176.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.29 -45.87 53.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.938 0.895 . . . . 0.0 112.152 -166.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.26 -8.74 7.01 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.025 -176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.53 3.64 90.1 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 120.167 -0.24 . . . . 0.0 113.022 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.547 HG12 HG21 ' A' ' 78' ' ' VAL . 59.2 t -81.89 83.8 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.928 0.891 . . . . 0.0 109.239 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -130.53 159.41 37.19 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.766 1.226 . . . . 0.0 109.009 178.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.51 24.73 62.33 Favored Glycine 0 C--N 1.337 0.638 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -167.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.547 HG21 HG12 ' A' ' 75' ' ' VAL . 28.0 m -122.4 17.47 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.299 1.44 . . . . 0.0 109.903 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 82' ' ' LEU . 25.6 t70 -63.96 -31.76 73.06 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.704 0.802 . . . . 0.0 112.063 -170.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -60.91 -48.78 80.24 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.023 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.402 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.1 mt-10 -63.57 -37.18 86.34 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.495 0.718 . . . . 0.0 111.429 178.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 79' ' ' ASP . 92.1 mt -62.4 -38.11 88.4 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.002 0.921 . . . . 0.0 111.392 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.28 -24.5 59.27 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.451 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.23 -2.79 58.63 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.699 0.799 . . . . 0.0 111.945 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 70.9 mt -77.74 115.33 17.41 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.041 0.448 . . . . 0.0 110.403 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -116.45 -1.71 12.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.369 1.068 . . . . 0.0 109.945 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 p -143.24 137.81 29.18 Favored 'General case' 0 C--O 1.257 1.484 0 C-N-CA 124.732 1.213 . . . . 0.0 109.608 -176.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.418 ' HA ' ' HE3' ' A' ' 52' ' ' MET . 53.4 t -64.86 -35.38 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 -176.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 34.0 t70 -61.93 -35.25 77.86 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.78 0.432 . . . . 0.0 111.001 179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -68.48 -28.11 66.74 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.811 0.444 . . . . 0.0 111.713 176.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 69' ' ' LEU . 65.7 tp -61.99 -41.0 97.54 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 123.196 0.31 . . . . 0.0 110.616 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.407 ' HD1' ' O ' ' A' ' 88' ' ' VAL . 25.7 m-85 -66.29 -39.47 89.38 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.42 0.688 . . . . 0.0 111.751 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 61.7 mm-40 -69.55 -35.43 75.4 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 78' ' ' VAL . 43.2 tp -58.33 -55.43 35.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.011 0.924 . . . . 0.0 110.456 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.38 -46.46 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.785 -177.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.17 -54.63 43.61 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.658 0.783 . . . . 0.0 112.032 -176.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.23 -43.16 82.67 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.393 0.677 . . . . 0.0 111.506 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -75.83 -18.23 59.54 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.349 0.406 . . . . 0.0 112.057 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -86.34 -28.56 23.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.53 -43.7 63.17 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.352 0.661 . . . . 0.0 110.565 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 124.769 1.228 . . . . 0.0 111.47 178.513 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.3 ptm . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 119.985 -0.055 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.83 -50.33 67.08 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 124.259 1.023 . . . . 0.0 110.826 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -69.17 -31.99 71.01 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 123.683 0.614 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -65.73 -42.52 90.91 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.692 176.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.4 tt -70.68 -32.68 70.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.86 1.264 . . . . 0.0 109.173 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.7 tp -67.75 -36.72 81.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.162 0.985 . . . . 0.0 109.909 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.1 m -69.99 -36.29 75.05 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.15 0.98 . . . . 0.0 110.766 176.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.53 -46.78 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.384 0.674 . . . . 0.0 110.059 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.407 HD21 HD21 ' A' ' 91' ' ' LEU . 98.4 mt -68.33 -28.56 67.26 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.109 0.964 . . . . 0.0 111.606 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -65.4 -53.71 39.23 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.202 0.601 . . . . 0.0 110.249 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.85 -37.03 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.784 -178.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.83 -50.53 66.31 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.107 0.563 . . . . 0.0 111.33 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m -79.68 -21.0 45.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.277 0.631 . . . . 0.0 111.142 -178.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.35 4.77 83.29 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-O 119.769 -0.462 . . . . 0.0 113.6 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.8 m -105.86 149.39 37.95 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.357 1.063 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.523 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 29.7 Cg_endo -61.75 160.16 30.01 Favored 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 122.176 1.917 . . . . 0.0 112.389 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.18 -20.88 65.81 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.582 0.753 . . . . 0.0 111.649 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -68.86 -20.2 64.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.025 0.93 . . . . 0.0 112.109 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.523 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 18.0 mm-40 -82.24 -29.11 31.48 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.21 0.604 . . . . 0.0 110.527 174.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 HD23 ' A' ' 55' ' ' LEU . 6.2 mt -88.71 90.83 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.54 -172.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.3 t -79.22 -0.64 32.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.562 0.745 . . . . 0.0 111.794 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 mtm180 75.15 -35.78 0.29 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 126.465 1.906 . . . . 0.0 112.067 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -76.97 3.1 12.97 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.25 1.02 . . . . 0.0 111.327 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.7 t -54.17 132.67 43.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.399 1.079 . . . . 0.0 110.825 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -91.99 31.35 1.26 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.773 0.829 . . . . 0.0 111.446 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.753 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 17.0 mmt 62.86 15.94 8.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.147 0.979 . . . . 0.0 112.694 174.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.66 -46.16 89.86 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.475 0.71 . . . . 0.0 112.32 -168.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -124.9 5.45 8.03 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.936 0.894 . . . . 0.0 109.972 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.426 HD23 HG12 ' A' ' 46' ' ' ILE . 3.5 mp -123.65 122.02 37.05 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.277 0.631 . . . . 0.0 110.235 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.612 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 74.2 -28.93 0.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.753 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 50.4 t80 -82.56 -19.45 38.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.539 0.736 . . . . 0.0 112.731 -169.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.86 136.18 57.93 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.703 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.9 m -54.36 -39.66 67.37 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.654 0.782 . . . . 0.0 113.084 -170.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.3 -42.27 93.23 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.39 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 27.2 t -74.99 -23.28 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.402 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.2 t -71.58 -34.03 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 172.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.1 m -69.94 -31.71 69.59 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.467 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -77.33 -29.12 53.35 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.43 0.692 . . . . 0.0 111.224 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -48.05 58.45 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.411 0.685 . . . . 0.0 109.35 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 26.9 p -61.81 -39.0 90.23 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.281 176.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.2 tp -57.62 -52.15 66.58 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.685 0.794 . . . . 0.0 111.325 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -68.78 -61.7 1.7 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.495 -175.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.6 mt -51.69 -35.68 43.65 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.78 0.675 . . . . 0.0 111.89 -176.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 66' ' ' SER . 60.8 ttt180 -55.81 -44.42 77.84 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.004 1.322 . . . . 0.0 112.816 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -100.17 -54.61 2.83 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.191 0.596 . . . . 0.0 111.619 -178.056 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -51.99 -48.7 64.3 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.239 1.416 . . . . 0.0 112.413 -176.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -116.59 -12.2 10.97 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.208 0.603 . . . . 0.0 111.884 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.44 -11.22 59.27 Favored Glycine 0 N--CA 1.473 1.161 0 CA-C-O 120.046 -0.308 . . . . 0.0 113.465 -176.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.672 HG21 HG13 ' A' ' 95' ' ' VAL . 50.6 t -71.7 92.52 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 124.514 1.125 . . . . 0.0 109.989 -174.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -117.66 166.1 12.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.272 0.629 . . . . 0.0 110.936 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.22 65.79 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.575 0.547 . . . . 0.0 113.027 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.408 HG11 HG12 ' A' ' 75' ' ' VAL . 27.3 m -98.8 8.94 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.086 0.955 . . . . 0.0 111.75 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' A' ' 82' ' ' LEU . 6.8 p-10 -58.38 -33.38 69.54 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.622 1.169 . . . . 0.0 111.509 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -58.71 -57.83 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.68 1.192 . . . . 0.0 110.958 175.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG3' HD11 ' A' ' 94' ' ' LEU . 9.6 pt-20 -77.42 -19.66 55.76 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.03 -174.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 79' ' ' ASP . 34.8 mt -64.41 -39.64 94.25 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.046 0.938 . . . . 0.0 110.233 169.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -67.84 -35.65 78.96 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.484 173.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.51 -4.21 47.46 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.481 0.712 . . . . 0.0 112.744 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 91' ' ' LEU . 87.4 mt -74.91 140.69 43.96 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.776 0.43 . . . . 0.0 111.476 177.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.36 -0.1 5.68 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.222 1.009 . . . . 0.0 109.666 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p -155.09 140.03 17.3 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.305 1.042 . . . . 0.0 110.868 -170.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.3 t -75.77 -33.2 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.025 0.93 . . . . 0.0 111.329 -174.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.58 -38.31 87.09 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.155 0.502 . . . . 0.0 110.705 176.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.29 -29.48 68.27 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.962 0.905 . . . . 0.0 111.528 174.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.505 ' HB2' HD13 ' A' ' 85' ' ' LEU . 33.7 tp -66.72 -38.72 87.27 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.647 0.379 . . . . 0.0 111.553 171.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -61.39 -48.1 82.8 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 174.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -62.85 -30.02 71.19 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.702 0.801 . . . . 0.0 112.447 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' A' ' 81' ' ' GLU . 7.1 tt -61.27 -58.18 9.31 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.385 1.074 . . . . 0.0 109.206 175.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 HG21 ' A' ' 75' ' ' VAL . 96.4 t -63.92 -40.37 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.966 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.69 -35.78 80.94 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.711 0.804 . . . . 0.0 111.309 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -66.71 -46.6 75.01 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -72.09 -24.31 61.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.715 0.806 . . . . 0.0 111.456 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.3 -34.0 59.07 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.05 -18.91 38.03 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.543 0.737 . . . . 0.0 111.354 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.442 0 C-N-CA 125.291 1.437 . . . . 0.0 112.059 -172.523 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.973 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.42 -46.35 90.31 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 124.11 0.964 . . . . 0.0 111.423 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.13 -37.32 87.06 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.807 0.692 . . . . 0.0 110.469 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.471 ' O ' HG23 ' A' ' 34' ' ' VAL . 27.5 m170 -72.89 -30.36 63.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.455 0.702 . . . . 0.0 110.734 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.48 -34.65 65.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.151 0.98 . . . . 0.0 108.848 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.15 -31.81 70.73 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.579 175.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.5 m -70.13 -38.84 75.63 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.004 0.922 . . . . 0.0 110.243 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 30' ' ' HIS . 67.5 t -57.87 -50.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.207 0.603 . . . . 0.0 109.713 174.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 81.9 mt -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.005 0.922 . . . . 0.0 112.078 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.4 t -64.26 -48.58 75.2 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.132 0.573 . . . . 0.0 110.661 178.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -77.97 -23.18 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.862 0.865 . . . . 0.0 110.841 -177.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.52 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -79.38 -42.89 24.55 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.435 0.694 . . . . 0.0 111.014 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.3 p -80.52 -53.58 6.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.391 0.676 . . . . 0.0 110.593 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.3 -23.57 6.79 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.853 -174.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.2 m -87.14 149.83 48.26 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 123.582 0.753 . . . . 0.0 109.764 176.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.473 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 69.6 Cg_endo -71.22 165.88 31.01 Favored 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 122.394 2.063 . . . . 0.0 112.164 179.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.15 -26.97 66.7 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.714 0.806 . . . . 0.0 111.406 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.04 -33.33 75.21 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.643 0.777 . . . . 0.0 111.739 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 13.2 mm-40 -84.91 -18.86 33.36 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.241 0.616 . . . . 0.0 111.734 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.9 mt -97.6 154.19 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.78 0.832 . . . . 0.0 109.66 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 t -155.68 177.13 11.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -59.07 -40.99 86.91 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -79.99 81.34 6.27 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.458 -1.246 . . . . 0.0 108.497 176.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.1 t -162.1 113.95 1.68 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-N 114.278 -1.328 . . . . 0.0 108.388 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -68.37 108.66 3.32 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.54 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 50.6 ttm -73.47 76.55 1.43 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.206 1.402 . . . . 0.0 110.461 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -123.72 16.32 9.48 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.974 0.909 . . . . 0.0 109.852 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -157.55 -44.68 0.07 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.456 1.102 . . . . 0.0 109.663 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.409 ' H ' HD12 ' A' ' 55' ' ' LEU . 5.0 mp -69.51 -30.26 68.08 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.927 -170.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -154.84 39.37 0.43 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.238 0.615 . . . . 0.0 110.374 179.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -106.83 -30.96 8.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.855 -176.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.53 140.84 58.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.398 0.679 . . . . 0.0 110.738 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -54.14 -43.54 70.63 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.179 0.992 . . . . 0.0 113.464 -173.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 tt -68.36 -39.0 81.95 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.52 HG13 ' HB1' ' A' ' 38' ' ' ALA . 36.4 t -69.34 -32.9 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 122.984 0.514 . . . . 0.0 111.243 -179.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.9 -40.47 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.246 0.618 . . . . 0.0 109.816 175.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 33.7 m -64.89 -47.64 77.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.031 176.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.21 -41.18 83.45 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.706 1.202 . . . . 0.0 110.482 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.466 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 40.8 tp -64.66 -50.98 64.94 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.29 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -55.48 -47.58 75.91 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.012 0.925 . . . . 0.0 111.966 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 63' ' ' SER . 87.9 mt -66.39 -35.53 80.57 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.457 0.703 . . . . 0.0 111.27 -178.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -73.42 -40.98 63.83 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 123.64 0.587 . . . . 0.0 110.468 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.0 mt -65.9 -36.34 83.12 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.579 0.752 . . . . 0.0 110.2 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 ttp85 -62.46 -51.0 69.23 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.553 1.141 . . . . 0.0 110.966 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -49.37 51.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.466 -174.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -88.15 -53.54 4.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.567 0.747 . . . . 0.0 111.53 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 69' ' ' LEU . 92.8 m-85 -94.59 -13.54 25.86 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.31 0.644 . . . . 0.0 112.155 -171.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.1 5.05 90.02 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 116.915 -0.129 . . . . 0.0 113.106 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.44 HG21 HG13 ' A' ' 95' ' ' VAL . 75.9 t -81.95 111.29 18.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.036 0.934 . . . . 0.0 109.512 -179.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.7 p -62.52 171.55 1.93 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.089 0.955 . . . . 0.0 112.293 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.7 92.49 0.01 OUTLIER Glycine 0 C--N 1.358 1.755 0 O-C-N 124.147 0.904 . . . . 0.0 113.353 -177.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 8.9 m -104.39 37.61 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.371 1.068 . . . . 0.0 110.663 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.55 -41.31 66.33 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.429 1.092 . . . . 0.0 112.29 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -62.93 -44.7 95.35 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.77 0.828 . . . . 0.0 110.609 176.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 25.7 mm-40 -64.92 -31.88 73.33 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.955 178.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 76.0 mt -71.73 -36.72 70.56 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.168 0.587 . . . . 0.0 111.731 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -75.83 -23.2 55.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 110.661 -0.126 . . . . 0.0 110.661 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 81' ' ' GLU . 89.6 mt -68.55 -19.55 64.5 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.3 0.64 . . . . 0.0 111.882 171.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 29.3 mt -82.6 150.66 26.74 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.956 0.503 . . . . 0.0 110.111 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -136.12 -6.1 2.09 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.044 0.938 . . . . 0.0 109.594 175.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.2 m -141.64 154.32 45.3 Favored 'General case' 0 C--O 1.246 0.897 0 C-N-CA 123.027 0.531 . . . . 0.0 110.277 -174.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.04 -32.12 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 123.727 0.811 . . . . 0.0 111.42 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.67 -49.44 67.98 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.074 0.55 . . . . 0.0 110.72 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.01 -37.74 83.6 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.295 -176.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.5 tp -67.29 -47.87 69.33 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.358 0.412 . . . . 0.0 111.848 176.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -59.59 -43.84 93.57 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.556 0.742 . . . . 0.0 111.778 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.7 -31.21 57.08 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.14 0.275 . . . . 0.0 111.479 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.15 -51.23 68.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.984 0.513 . . . . 0.0 110.403 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.44 HG13 HG21 ' A' ' 75' ' ' VAL . 81.1 t -65.47 -42.02 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.847 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -63.65 -45.78 88.6 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 123.672 0.607 . . . . 0.0 111.373 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -73.82 -28.23 61.51 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.212 0.605 . . . . 0.0 111.49 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -81.33 -19.97 41.68 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.681 0.392 . . . . 0.0 110.789 175.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -81.78 -30.63 32.24 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 174.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.5 -30.56 29.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.812 0.845 . . . . 0.0 110.668 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.781 0 C-N-CA 124.07 0.948 . . . . 0.0 108.798 178.424 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.05 80.82 1.55 Allowed Glycine 0 C--N 1.344 1.006 0 O-C-N 123.318 0.386 . . . . 0.0 112.192 178.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.1 p -163.51 145.88 9.8 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.166 0.986 . . . . 0.0 109.215 178.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 t -156.09 58.9 0.59 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -68.33 123.8 21.76 Favored 'General case' 0 C--N 1.353 0.759 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.495 -174.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -146.87 115.48 6.76 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.581 1.153 . . . . 0.0 107.93 174.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -114.31 39.63 2.72 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.193 0.597 . . . . 0.0 109.641 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 t60 -59.06 126.83 29.3 Favored 'General case' 0 C--N 1.357 0.916 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.738 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -102.2 134.14 45.93 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.954 0.902 . . . . 0.0 108.832 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -65.86 -35.77 81.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 123.58 0.55 . . . . 0.0 110.693 177.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.2 m 71.31 124.82 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 125.289 1.435 . . . . 0.0 110.83 -176.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.4 p -147.95 34.85 0.83 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.417 1.087 . . . . 0.0 109.562 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.82 100.83 0.22 Allowed Glycine 0 C--N 1.357 1.697 0 CA-C-N 115.196 -0.911 . . . . 0.0 113.013 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -136.76 139.57 41.94 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 124.166 0.986 . . . . 0.0 108.393 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -161.35 99.14 1.16 Allowed 'General case' 0 C--O 1.241 0.619 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -177.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -164.89 100.91 0.77 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.5 mp -115.05 116.57 28.65 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.654 0.782 . . . . 0.0 109.778 -174.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -124.4 160.22 28.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.154 0.982 . . . . 0.0 109.785 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -105.03 20.76 18.29 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 109.982 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.87 93.22 0.96 Allowed 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.603 0.761 . . . . 0.0 110.447 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -153.67 19.3 0.68 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.951 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -110.77 126.33 54.48 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.188 0.995 . . . . 0.0 109.004 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 88.2 mtp 59.47 81.24 0.25 Allowed Pre-proline 0 CA--C 1.555 1.155 0 O-C-N 124.635 1.209 . . . . 0.0 111.546 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.12 80.22 2.51 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 122.44 2.093 . . . . 0.0 110.342 174.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.7 -45.71 77.8 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.482 1.113 . . . . 0.0 110.982 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -90.25 96.89 10.88 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.914 175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.6 ttt -55.64 -40.82 72.7 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.894 170.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.31 -41.39 88.91 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 124.51 1.131 . . . . 0.0 111.539 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.68 -45.29 93.47 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.139 0.576 . . . . 0.0 110.721 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -70.3 -33.48 71.6 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.725 0.641 . . . . 0.0 110.696 -175.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.03 -36.31 61.9 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.899 0.88 . . . . 0.0 108.716 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.62 -32.74 74.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.283 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.522 ' HA ' ' HE3' ' A' ' 43' ' ' LYS . 77.9 m -72.57 -38.25 67.97 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.866 0.866 . . . . 0.0 110.627 176.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.29 -45.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.393 0.677 . . . . 0.0 110.127 172.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 71.6 mt -68.82 -37.15 79.01 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.093 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.5 t -67.98 -29.36 68.37 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.375 0.67 . . . . 0.0 111.448 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.4 t -85.23 -43.11 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 123.439 0.696 . . . . 0.0 110.272 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.9 -43.72 87.34 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.534 0.734 . . . . 0.0 111.222 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 13.6 m -81.41 -30.44 33.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.849 0.859 . . . . 0.0 110.169 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.07 -11.29 65.48 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.397 -0.365 . . . . 0.0 113.331 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 33.4 m -91.15 145.16 31.05 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 123.842 0.857 . . . . 0.0 110.61 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -54.88 169.91 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.852 3.034 . . . . 0.0 115.432 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 33' ' ' THR . 44.5 mmtm -60.25 -34.92 74.37 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.115 -176.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -65.85 -30.95 71.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.314 0.646 . . . . 0.0 111.571 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.55 -4.29 55.6 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mt -127.34 133.29 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.278 0.631 . . . . 0.0 109.507 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.6 t -135.51 167.83 20.36 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.586 0.754 . . . . 0.0 109.44 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -64.38 -55.68 19.45 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.75 89.82 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -170.31 154.26 4.76 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.197 -1.365 . . . . 0.0 108.457 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -94.25 153.34 18.09 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 123.79 0.836 . . . . 0.0 109.472 177.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.687 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 20.0 mmt -73.59 97.17 2.57 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.87 -121.61 0.26 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.374 1.069 . . . . 0.0 108.514 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -85.25 54.46 3.11 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 122.717 1.246 . . . . 0.0 109.25 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.4 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 87.2 mt -127.79 -46.41 1.42 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.778 -176.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.71 21.7 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.426 -177.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.687 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 49.0 t80 -122.58 75.85 1.29 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 121.965 0.888 . . . . 0.0 110.023 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.5 t70 179.55 135.74 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 113.506 -1.679 . . . . 0.0 107.16 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.3 p -52.03 -39.21 59.18 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.893 0.877 . . . . 0.0 113.118 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -68.09 -47.86 67.09 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.764 0.426 . . . . 0.0 110.677 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.47 -28.18 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 -176.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.9 t -74.75 -38.27 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.753 0.821 . . . . 0.0 109.86 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -68.07 -35.28 77.95 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.918 0.487 . . . . 0.0 110.525 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 10.5 tp10 -70.84 -42.92 69.53 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.388 0.675 . . . . 0.0 109.922 176.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 56' ' ' ALA . 56.0 tp -61.29 -48.43 81.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.305 1.042 . . . . 0.0 110.502 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 32.6 t -57.96 -47.64 82.33 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.134 0.974 . . . . 0.0 109.593 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 45.0 tp -53.29 -40.61 64.84 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.15 0.98 . . . . 0.0 111.22 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 71.9 mmtt -65.81 -55.11 18.85 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.566 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.454 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 97.7 mt -56.68 -32.14 65.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.082 0.953 . . . . 0.0 112.588 -173.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 66' ' ' SER . 45.7 mtm180 -59.75 -37.06 77.94 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.493 0.717 . . . . 0.0 111.044 178.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -93.91 -49.22 5.91 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.863 0.865 . . . . 0.0 111.239 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.59 -40.66 69.75 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.768 0.827 . . . . 0.0 111.83 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -125.5 -6.11 7.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.128 0.571 . . . . 0.0 111.909 -175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 75.78 3.6 73.96 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 113.609 0.204 . . . . 0.0 113.609 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.649 HG21 HG13 ' A' ' 95' ' ' VAL . 75.1 t -77.91 98.81 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.991 0.916 . . . . 0.0 109.679 -176.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 25.3 m -123.45 149.69 44.77 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.976 0.911 . . . . 0.0 110.168 -172.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.58 15.25 80.62 Favored Glycine 0 C--N 1.354 1.552 0 O-C-N 123.436 0.46 . . . . 0.0 113.827 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 15.9 m -92.05 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.166 0.986 . . . . 0.0 112.225 -173.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -54.42 -45.62 73.04 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.123 0.969 . . . . 0.0 111.938 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -65.5 -38.42 89.66 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 124.161 0.913 . . . . 0.0 110.982 -178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.472 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 5.1 mp0 -65.85 -40.38 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.248 1.019 . . . . 0.0 110.947 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.432 ' HA ' ' HG ' ' A' ' 85' ' ' LEU . 85.6 mt -76.01 -25.24 55.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 110.784 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.06 -28.34 62.26 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.061 0.944 . . . . 0.0 110.424 173.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -90.95 10.18 27.56 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.319 1.048 . . . . 0.0 112.35 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.613 HD13 ' HE3' ' A' ' 52' ' ' MET . 78.9 mt -79.53 126.99 31.58 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.89 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -126.73 -45.95 1.59 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.412 1.085 . . . . 0.0 108.083 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 35.5 p -115.61 154.86 28.68 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.816 0.817 . . . . 0.0 110.767 172.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.423 HG12 ' HE2' ' A' ' 92' ' ' PHE . 53.0 t -70.74 -36.82 66.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.115 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.71 -37.77 82.79 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.229 0.611 . . . . 0.0 110.56 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.27 -39.06 85.5 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 124.05 0.844 . . . . 0.0 110.854 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.434 HD13 HD11 ' A' ' 85' ' ' LEU . 44.3 tp -62.71 -42.36 99.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 123.401 0.438 . . . . 0.0 111.397 174.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.423 ' HE2' HG12 ' A' ' 88' ' ' VAL . 71.1 m-85 -59.57 -45.3 92.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.987 0.515 . . . . 0.0 110.638 175.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.15 -31.82 70.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.016 0.927 . . . . 0.0 111.445 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tt -70.22 -55.82 8.34 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.789 0.836 . . . . 0.0 109.653 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.649 HG13 HG21 ' A' ' 75' ' ' VAL . 59.6 t -64.49 -29.19 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 O-C-N 124.076 0.86 . . . . 0.0 110.15 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -61.53 -54.17 46.72 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.077 0.951 . . . . 0.0 110.175 173.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -69.41 -27.19 65.07 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.741 0.816 . . . . 0.0 111.308 -178.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -79.23 -32.29 43.88 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.927 0.891 . . . . 0.0 110.22 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -74.23 -41.09 61.91 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.475 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.47 97.29 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.706 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 62.02 -170.75 0.16 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 125.367 1.467 . . . . 0.0 112.295 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -109.24 12.73 33.79 Favored Glycine 0 C--N 1.347 1.148 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.356 174.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.793 0.837 . . . . 0.0 109.449 179.909 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -86.72 9.26 72.21 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.675 0.609 . . . . 0.0 113.383 177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.6 m -64.73 90.24 0.08 Allowed 'General case' 0 C--N 1.355 0.817 0 C-N-CA 124.217 1.007 . . . . 0.0 110.025 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -157.72 94.85 1.38 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.551 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -76.99 169.19 18.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.24 0.616 . . . . 0.0 109.484 173.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -76.72 154.9 33.69 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -144.21 151.84 40.04 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.888 0.875 . . . . 0.0 108.662 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -122.73 167.86 12.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.928 0.891 . . . . 0.0 109.473 -177.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -124.72 161.4 26.45 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.975 0.91 . . . . 0.0 110.109 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -154.19 130.8 10.68 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.189 0.996 . . . . 0.0 109.207 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.0 p -111.79 144.73 40.61 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.212 1.005 . . . . 0.0 109.637 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.3 p -74.4 -22.91 58.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.864 0.865 . . . . 0.0 111.478 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.05 -145.92 43.81 Favored Glycine 0 C--N 1.353 1.512 0 O-C-N 123.731 0.645 . . . . 0.0 111.515 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -162.39 134.28 5.41 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.292 0.637 . . . . 0.0 109.796 172.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -82.94 -25.34 32.47 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.969 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -71.51 104.57 3.31 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -135.37 -178.37 5.08 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.265 1.026 . . . . 0.0 110.055 -176.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 66.75 87.65 0.12 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.994 1.318 . . . . 0.0 111.386 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -110.35 10.97 23.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.667 0.787 . . . . 0.0 110.841 173.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -70.69 110.86 5.75 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.563 0.745 . . . . 0.0 109.845 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.04 -92.05 0.37 Allowed Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -170.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.5 m80 -135.02 -89.33 0.34 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 170.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 28.0 ttt -171.72 87.12 0.45 Allowed Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -78.51 155.15 27.94 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 122.683 2.255 . . . . 0.0 112.501 -177.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 60.64 89.01 0.08 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.464 1.106 . . . . 0.0 111.642 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -86.71 78.86 9.03 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -134.05 -60.0 0.82 Allowed 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.316 0.646 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.485 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 45.3 tt0 -73.16 -64.26 1.01 Allowed 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -171.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.07 -34.02 74.24 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.81 0.844 . . . . 0.0 110.115 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.6 t-160 -63.55 -42.8 98.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.094 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 91' ' ' LEU . 33.6 tp -74.36 -33.07 62.99 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.519 0.512 . . . . 0.0 110.959 -178.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.6 -28.78 69.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.329 0.252 . . . . 0.0 110.874 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.3 m -72.41 -43.77 63.4 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.827 0.451 . . . . 0.0 110.297 172.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.6 t -54.87 -44.49 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.705 0.802 . . . . 0.0 110.567 176.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.2 mt -68.12 -42.51 80.08 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.348 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.9 p -65.79 -34.74 78.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.729 0.299 . . . . 0.0 111.53 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.28 -36.79 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 C-N-CA 123.497 0.719 . . . . 0.0 110.83 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.32 -36.93 45.75 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.873 0.469 . . . . 0.0 112.038 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 m -87.23 -55.16 3.94 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.925 0.89 . . . . 0.0 110.33 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.5 -24.74 7.96 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.738 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.6 m -76.29 131.26 75.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 122.912 0.485 . . . . 0.0 110.041 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.479 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 25.5 Cg_endo -61.27 161.74 22.34 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.683 2.256 . . . . 0.0 112.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -59.39 -26.06 64.81 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 124.874 1.27 . . . . 0.0 112.467 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -68.38 -24.46 64.78 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.942 0.897 . . . . 0.0 111.369 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.479 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 12.9 mm-40 -85.92 -19.1 31.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.684 0.793 . . . . 0.0 110.92 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.3 mt -99.62 133.75 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.601 0.761 . . . . 0.0 110.33 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 t -121.86 168.55 11.73 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.861 0.864 . . . . 0.0 109.136 172.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -73.34 -20.55 60.76 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.926 0.491 . . . . 0.0 111.832 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.97 1.07 30.74 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.553 0.741 . . . . 0.0 111.801 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.5 t -65.32 152.14 44.52 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.203 0.601 . . . . 0.0 111.942 -171.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -73.87 160.47 31.38 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.616 0.767 . . . . 0.0 110.606 175.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.676 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 17.4 mmt -104.9 26.67 8.92 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.063 0.945 . . . . 0.0 110.805 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.05 -61.65 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.165 0.507 . . . . 0.0 110.468 -170.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -94.07 -16.16 24.08 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.1 mp -85.61 -17.08 37.22 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.184 0.994 . . . . 0.0 112.278 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -156.42 -152.82 0.39 Allowed 'General case' 0 C--O 1.246 0.908 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 62.56 61.79 1.19 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.445 1.098 . . . . 0.0 112.125 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -177.03 137.52 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 113.197 -1.819 . . . . 0.0 106.918 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.7 m -56.47 -35.44 67.94 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.745 0.653 . . . . 0.0 111.752 -175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -81.48 -38.48 26.28 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.958 0.503 . . . . 0.0 110.822 -174.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.36 -39.71 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 121.372 0.606 . . . . 0.0 110.752 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.544 HG13 ' HB2' ' A' ' 82' ' ' LEU . 56.1 t -72.8 -31.3 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.567 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.5 t -69.03 -33.77 74.16 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.688 0.395 . . . . 0.0 110.309 173.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -70.49 -40.4 73.63 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.158 0.983 . . . . 0.0 110.035 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 38.6 tp -74.36 -35.21 63.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.946 0.899 . . . . 0.0 111.246 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.3 p -72.49 -40.78 66.63 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.845 0.458 . . . . 0.0 109.938 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.0 tp -58.3 -38.76 77.7 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 124.181 0.925 . . . . 0.0 110.466 171.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -64.03 -57.97 8.08 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.469 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.413 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 91.2 mt -62.16 -36.27 81.33 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.579 0.752 . . . . 0.0 111.471 -177.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -56.18 -42.73 77.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.827 1.251 . . . . 0.0 110.886 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.3 tppt? -86.66 -32.65 20.42 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.261 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -90.42 -55.04 3.74 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.962 0.505 . . . . 0.0 111.786 -165.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -110.73 -1.83 16.5 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.847 0.859 . . . . 0.0 110.813 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.12 7.13 86.71 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.126 0.393 . . . . 0.0 113.245 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 42.4 t -81.92 95.02 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 123.597 0.759 . . . . 0.0 109.68 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.5 m -111.12 155.25 23.13 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.295 1.038 . . . . 0.0 111.322 -171.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.53 80.45 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 116.583 -0.28 . . . . 0.0 113.491 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 30.3 m -93.07 16.1 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.913 0.885 . . . . 0.0 111.551 -176.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -54.87 -52.48 62.69 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.139 0.975 . . . . 0.0 111.042 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -57.29 -42.91 82.6 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 24.1 mm-40 -60.55 -37.21 80.5 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.23 0.612 . . . . 0.0 111.421 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.544 ' HB2' HG13 ' A' ' 62' ' ' VAL . 87.3 mt -66.18 -35.29 80.06 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.956 0.902 . . . . 0.0 111.226 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -58.86 -43.0 90.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.698 172.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.7 -21.04 61.83 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 82.8 mt -76.76 126.78 31.56 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.53 0.332 . . . . 0.0 110.667 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -102.96 -26.75 12.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.525 0.73 . . . . 0.0 111.107 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 37.0 p -131.4 164.19 26.24 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.408 0.623 . . . . 0.0 111.263 -178.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 85.7 t -69.3 -36.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.016 -176.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.13 -29.27 68.14 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.977 0.511 . . . . 0.0 111.54 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HB3' HD22 ' A' ' 85' ' ' LEU . 47.1 mt-10 -66.5 -39.44 88.71 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.608 0.363 . . . . 0.0 110.476 171.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.499 ' HG ' HD21 ' A' ' 31' ' ' LEU . 37.5 tp -62.76 -42.78 99.84 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.983 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 21.1 m-85 -57.95 -58.24 9.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.436 0.694 . . . . 0.0 111.328 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -64.07 -24.88 67.87 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.443 0.464 . . . . 0.0 111.533 -176.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.6 tp -69.94 -50.04 45.92 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.293 0.371 . . . . 0.0 110.305 175.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 89.6 t -58.58 -44.99 90.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.056 0.542 . . . . 0.0 110.326 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -67.44 -46.74 72.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.83 0.852 . . . . 0.0 111.895 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -63.23 -56.13 19.11 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.495 0.718 . . . . 0.0 110.589 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -65.95 -22.27 66.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.367 1.067 . . . . 0.0 112.0 -175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -68.94 -56.95 6.26 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.266 0.626 . . . . 0.0 110.261 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -88.35 -62.41 1.5 Allowed 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.348 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.68 84.91 5.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.6 0.76 . . . . 0.0 110.027 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.72 37.45 3.34 Favored Glycine 0 CA--C 1.536 1.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.975 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 36.6 p . . . . . 0 C--O 1.253 1.237 0 C-N-CA 124.026 0.93 . . . . 0.0 109.353 -179.126 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.2 mtm . . . . . 0 N--CA 1.484 1.226 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.15 11.06 53.72 Favored Glycine 0 C--N 1.347 1.188 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.969 176.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.2 p -81.47 74.6 8.46 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.6 0.714 . . . . 0.0 110.584 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 m -87.36 118.25 26.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.336 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.6 m80 -136.31 93.75 2.93 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -98.06 99.01 10.25 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.741 0.816 . . . . 0.0 109.424 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -79.85 118.37 21.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.612 0.765 . . . . 0.0 109.596 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -155.06 115.21 3.8 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.143 0.577 . . . . 0.0 109.611 176.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -143.34 120.53 11.5 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.083 0.953 . . . . 0.0 108.845 175.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.1 t60 -149.57 84.23 1.42 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.076 0.95 . . . . 0.0 108.567 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 p -110.3 132.55 54.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.649 0.78 . . . . 0.0 110.065 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.6 p -161.4 -62.43 0.05 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.21 1.004 . . . . 0.0 109.151 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 82.07 137.41 2.51 Favored Glycine 0 C--N 1.347 1.16 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.749 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -83.73 -48.84 9.7 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.86 0.864 . . . . 0.0 109.872 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -90.9 82.63 5.64 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.177 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.27 149.84 25.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.746 0.819 . . . . 0.0 110.306 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.4 mt 64.26 -177.97 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.784 1.233 . . . . 0.0 112.823 173.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -147.48 107.23 3.96 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.592 0.757 . . . . 0.0 109.557 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -107.58 98.12 7.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -120.12 82.86 1.96 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.844 0.858 . . . . 0.0 109.919 -174.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.94 -42.56 6.7 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.31 -178.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -75.63 98.49 4.05 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.456 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . 21.6 ptt? -148.48 91.27 4.75 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 123.839 0.856 . . . . 0.0 109.473 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -79.96 8.72 3.9 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 123.165 2.577 . . . . 0.0 113.991 -174.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 23' ' ' MET . 8.9 p30 -72.06 -47.08 54.2 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.301 0.641 . . . . 0.0 111.499 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.0 t70 53.25 71.56 0.49 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.332 1.053 . . . . 0.0 109.734 -173.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -170.62 -55.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.777 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.38 -41.44 89.38 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.612 0.765 . . . . 0.0 111.349 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -74.22 -29.91 61.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.947 1.299 . . . . 0.0 110.814 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.426 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.1 t60 -70.79 -48.72 52.72 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.702 0.801 . . . . 0.0 109.792 -178.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.524 HD23 ' HG ' ' A' ' 91' ' ' LEU . 8.1 mp -62.62 -35.98 81.29 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.265 0.978 . . . . 0.0 110.384 175.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.9 tp -61.19 -39.5 90.4 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.915 0.886 . . . . 0.0 110.905 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.4 m -70.23 -39.76 74.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.896 0.878 . . . . 0.0 110.977 175.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.513 HG13 ' HG2' ' A' ' 68' ' ' LYS . 64.5 t -59.77 -48.41 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.367 0.667 . . . . 0.0 110.553 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.32 -31.5 71.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.722 0.809 . . . . 0.0 111.256 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 t -61.72 -43.21 99.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.306 0.642 . . . . 0.0 111.356 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.6 t -79.07 -46.03 23.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.036 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.5 -43.27 73.46 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.852 0.861 . . . . 0.0 112.085 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 m -91.8 -15.35 28.38 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.156 0.582 . . . . 0.0 111.617 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.12 21.5 70.51 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 114.239 0.455 . . . . 0.0 114.239 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -109.47 152.76 42.91 Favored Pre-proline 0 N--CA 1.478 0.933 0 C-N-CA 124.245 1.018 . . . . 0.0 110.442 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.76 151.92 45.19 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.506 2.137 . . . . 0.0 112.384 165.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.75 -26.41 68.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.756 0.822 . . . . 0.0 111.32 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -75.28 -19.98 59.39 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.138 0.975 . . . . 0.0 111.573 -176.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.59 -36.59 73.64 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.551 0.691 . . . . 0.0 109.487 176.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG23 HG21 ' A' ' 88' ' ' VAL . 47.9 mt -91.18 89.65 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.827 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.3 m -94.18 26.49 3.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.715 0.806 . . . . 0.0 110.669 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.16 -48.17 0.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.136 1.774 . . . . 0.0 110.302 -168.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.28 82.35 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.595 0.758 . . . . 0.0 109.683 164.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB2' HG21 ' A' ' 88' ' ' VAL . 48.8 m -160.57 153.76 21.74 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.548 1.139 . . . . 0.0 109.127 -177.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -101.58 135.95 42.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.058 0.943 . . . . 0.0 109.953 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.526 ' HB3' ' HB3' ' A' ' 56' ' ' ALA . 71.9 mmm -81.54 6.41 14.96 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.963 0.505 . . . . 0.0 111.644 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.81 -30.95 71.17 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.491 0.716 . . . . 0.0 111.265 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.44 -43.67 6.81 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.401 167.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 62.2 mt -75.97 -11.5 59.97 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.526 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -169.36 13.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -108.3 -20.14 13.24 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-N 118.477 0.581 . . . . 0.0 112.341 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.428 ' O ' HG23 ' A' ' 62' ' ' VAL . 24.3 t70 -70.68 135.47 48.35 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 m -54.38 -35.84 63.26 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -172.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.45 -41.12 73.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.27 -35.89 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 123.866 0.729 . . . . 0.0 111.286 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 58' ' ' ASP . 62.4 t -64.06 -44.9 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.7 t -69.24 -37.82 78.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.922 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.93 -35.34 64.59 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.788 0.835 . . . . 0.0 110.796 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.15 -41.39 63.98 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.183 0.993 . . . . 0.0 109.527 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.3 t -60.23 -43.57 95.94 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.709 0.803 . . . . 0.0 109.835 173.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.72 -40.47 95.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.801 1.24 . . . . 0.0 110.639 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.513 ' HG2' HG13 ' A' ' 34' ' ' VAL . 6.7 tppt? -72.39 -56.58 5.22 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.246 -171.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.568 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 87.2 mt -57.99 -34.47 70.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.542 0.737 . . . . 0.0 111.261 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG3' ' HB ' ' A' ' 76' ' ' THR . 72.0 ttt180 -59.04 -34.9 72.46 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.07 1.348 . . . . 0.0 112.222 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.3 tmtm? -94.32 -58.39 2.23 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 122.953 0.501 . . . . 0.0 110.342 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -54.02 -44.43 70.94 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.663 1.185 . . . . 0.0 112.31 -176.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -118.75 -27.22 5.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.25 0.62 . . . . 0.0 112.162 -173.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.8 7.08 64.91 Favored Glycine 0 N--CA 1.471 1.023 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.568 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 99.0 t -75.85 90.36 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.045 0 C-N-CA 124.153 0.981 . . . . 0.0 109.44 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.445 ' HB ' ' HG3' ' A' ' 70' ' ' ARG . 11.4 t -115.2 163.87 15.03 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.134 0.974 . . . . 0.0 111.069 -174.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.65 21.71 65.28 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.701 -0.682 . . . . 0.0 113.359 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 20.6 m -97.97 13.64 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.955 0.902 . . . . 0.0 111.646 -177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -48.85 -51.01 31.94 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.415 1.486 . . . . 0.0 112.373 -178.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.51 -50.53 72.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.963 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.67 -30.34 71.31 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.29 -177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.6 mt -70.47 -36.18 73.73 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.257 0.623 . . . . 0.0 110.244 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -74.59 -23.96 58.82 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.135 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.79 -13.21 59.93 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.985 0.514 . . . . 0.0 111.752 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 80.3 mt -70.74 158.76 35.72 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.715 0.406 . . . . 0.0 110.734 176.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -136.57 -42.53 0.61 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.05 0.54 . . . . 0.0 110.103 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.422 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 74.9 p -115.71 159.44 21.39 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.315 0.646 . . . . 0.0 111.084 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.459 HG21 HG23 ' A' ' 46' ' ' ILE . 69.0 t -59.21 -36.69 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.137 177.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.405 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 8.0 m-20 -58.52 -35.71 72.7 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.458 176.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.422 ' HG2' ' OG1' ' A' ' 87' ' ' THR . 37.0 mm-40 -70.52 -37.3 74.09 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.251 0.621 . . . . 0.0 111.743 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.524 ' HG ' HD23 ' A' ' 31' ' ' LEU . 65.7 tp -61.88 -42.53 99.18 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 121.149 0.5 . . . . 0.0 110.607 173.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -63.06 -38.19 90.19 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.436 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 86.8 mm-40 -64.98 -48.27 74.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.913 175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.4 tt -53.15 -61.06 2.54 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.532 1.133 . . . . 0.0 110.161 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.473 HG11 HD11 ' A' ' 31' ' ' LEU . 43.7 t -68.63 -31.62 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.236 -173.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.659 ' HG3' HH21 ' A' ' 99' ' ' ARG . 40.3 tt0 -61.05 -45.17 95.87 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.24 0.616 . . . . 0.0 111.086 174.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 74.1 mmtt -67.98 -46.26 71.85 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.869 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -70.06 -24.63 63.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.879 0.471 . . . . 0.0 111.551 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.659 HH21 ' HG3' ' A' ' 96' ' ' GLU . 18.5 ttp180 -66.84 -44.49 80.94 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.856 0.862 . . . . 0.0 109.853 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -89.54 -0.41 57.49 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.61 0.764 . . . . 0.0 111.94 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 65.27 75.0 0.37 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.297 1.439 . . . . 0.0 111.412 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.57 59.44 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 115.159 -0.928 . . . . 0.0 114.932 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.249 1.052 0 C-N-CA 123.254 0.622 . . . . 0.0 109.459 -174.623 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.01 165.44 37.72 Favored Glycine 0 C--N 1.345 1.042 0 N-CA-C 111.798 -0.521 . . . . 0.0 111.798 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.2 p -96.72 115.93 28.26 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.65 0.78 . . . . 0.0 110.184 -178.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.7 t -105.21 172.48 6.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.724 0.81 . . . . 0.0 110.338 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -154.48 161.18 41.81 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.835 0.854 . . . . 0.0 109.75 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -110.94 -172.69 2.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.716 0.806 . . . . 0.0 109.623 173.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -165.95 83.49 0.31 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.792 0.837 . . . . 0.0 109.249 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -63.38 126.88 28.9 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.23 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -141.8 124.4 15.88 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.661 0.784 . . . . 0.0 110.269 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -103.74 155.23 18.75 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.891 0.877 . . . . 0.0 109.182 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.0 p -155.8 34.08 0.35 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.016 0.927 . . . . 0.0 110.123 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.7 m -76.03 179.59 5.52 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.332 1.053 . . . . 0.0 112.121 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 86.84 16.93 60.57 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 123.14 0.4 . . . . 0.0 112.474 -178.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -81.58 125.12 30.15 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.034 0.934 . . . . 0.0 110.114 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -144.98 144.49 31.07 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.737 0.815 . . . . 0.0 110.069 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -155.47 88.8 1.16 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.787 0.835 . . . . 0.0 109.319 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.01 168.48 17.79 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.658 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.1 p90 -150.2 165.29 33.36 Favored 'General case' 0 C--O 1.246 0.902 0 C-N-CA 124.295 1.038 . . . . 0.0 109.946 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -156.29 15.06 0.32 Allowed 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 121.448 0.642 . . . . 0.0 110.369 173.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -79.08 86.29 4.92 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.874 -0.516 . . . . 0.0 110.066 -177.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.19 82.03 0.06 OUTLIER Glycine 0 C--N 1.34 0.793 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.756 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -159.01 133.56 7.96 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.47 0.708 . . . . 0.0 109.971 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.8 tpt -144.19 87.85 7.68 Favored Pre-proline 0 N--CA 1.478 0.962 0 C-N-CA 124.034 0.934 . . . . 0.0 109.109 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -77.72 86.6 1.62 Allowed 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.744 2.296 . . . . 0.0 111.027 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -136.5 88.75 2.4 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.124 0.569 . . . . 0.0 110.581 -175.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 25.9 t70 -171.41 157.16 4.8 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.616 1.166 . . . . 0.0 108.465 176.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.1 tpt -56.96 -63.44 1.21 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.607 1.163 . . . . 0.0 110.782 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.418 ' HA ' HD23 ' A' ' 31' ' ' LEU . 39.1 mt-10 -65.52 -32.67 74.39 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.141 0.976 . . . . 0.0 111.143 -175.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.409 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 6.8 t70 -54.03 -47.44 71.57 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 124.398 1.061 . . . . 0.0 110.793 172.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 34' ' ' VAL . 7.7 m-70 -72.77 -26.65 61.62 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.437 -175.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.429 HD11 HG21 ' A' ' 95' ' ' VAL . 3.5 mm? -60.79 -45.52 94.09 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.731 0.696 . . . . 0.0 109.314 168.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 5.9 mp -66.11 -36.31 82.83 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.478 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -68.25 -42.31 79.84 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.576 0.75 . . . . 0.0 110.682 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.545 HG13 ' HD2' ' A' ' 68' ' ' LYS . 61.3 t -61.13 -49.83 83.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.857 0.463 . . . . 0.0 110.505 178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 90.8 mt -66.74 -39.17 87.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.928 0.767 . . . . 0.0 112.291 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.9 p -65.52 -45.2 84.44 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.154 0.582 . . . . 0.0 111.59 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.0 t -71.13 -30.49 41.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 114.68 -1.145 . . . . 0.0 110.3 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.62 -37.24 62.87 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.061 0.544 . . . . 0.0 112.203 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.494 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 80.7 p -95.01 -60.95 1.57 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.183 0.593 . . . . 0.0 110.993 -173.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.5 -30.95 2.27 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.003 -177.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -72.12 141.3 83.68 Favored Pre-proline 0 C--N 1.356 0.854 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.899 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.552 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 19.3 Cg_endo -59.47 152.59 60.42 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.457 2.105 . . . . 0.0 112.307 176.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.471 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 13.7 ptmm? -60.78 -20.3 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.426 1.09 . . . . 0.0 112.316 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.63 -35.64 80.67 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.839 0.855 . . . . 0.0 111.32 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.552 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 20.3 mm-40 -75.94 -11.97 60.06 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.684 0.794 . . . . 0.0 111.942 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.447 ' HB ' ' HG ' ' A' ' 32' ' ' LEU . 23.7 mt -98.17 123.12 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 123.056 0.542 . . . . 0.0 110.478 -176.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 86.7 p -136.1 179.33 6.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.416 1.486 . . . . 0.0 107.692 172.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 89' ' ' ASP . 8.4 ptm180 -52.17 -56.36 15.06 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 123.558 0.743 . . . . 0.0 112.566 177.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -94.61 17.66 12.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.631 -0.668 . . . . 0.0 111.919 -175.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.0 t -70.55 -13.31 62.05 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.079 0.552 . . . . 0.0 111.165 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.448 ' HD3' HG23 ' A' ' 87' ' ' THR . 26.7 mmt180 71.51 177.06 0.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.145 1.378 . . . . 0.0 111.44 175.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.504 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 34.4 mtt -129.44 29.0 5.14 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.654 0.782 . . . . 0.0 111.401 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -56.78 -40.57 76.11 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.595 0.758 . . . . 0.0 110.659 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.03 -23.92 7.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.238 1.015 . . . . 0.0 110.597 174.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 5.0 mp -77.2 -30.17 54.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.682 0.793 . . . . 0.0 112.82 -166.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -166.03 89.18 0.4 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.4 0.68 . . . . 0.0 110.499 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -160.22 -33.65 0.06 Allowed 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.942 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -63.92 147.42 52.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.958 0.903 . . . . 0.0 111.424 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -55.76 -44.88 78.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.852 0.861 . . . . 0.0 112.422 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.3 tp -68.68 -39.28 80.63 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.732 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.519 HG13 ' HB1' ' A' ' 38' ' ' ALA . 81.0 t -65.8 -48.91 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 78.4 t -68.32 -38.82 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.753 0.821 . . . . 0.0 111.439 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 68.4 p -61.96 -55.66 27.13 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -61.65 -27.46 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.626 0.77 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 41.6 tp -64.26 -49.05 73.4 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.149 0.979 . . . . 0.0 109.852 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 85.2 p -68.24 -34.75 76.79 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.568 0.347 . . . . 0.0 111.26 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 63' ' ' SER . 85.1 mt -68.67 -33.09 73.39 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.703 0.801 . . . . 0.0 111.788 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' HG13 ' A' ' 34' ' ' VAL . 29.4 ttmt -85.5 -43.72 13.32 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.804 -175.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 94.3 mt -61.25 -27.9 68.78 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.534 0.734 . . . . 0.0 110.766 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -57.69 -40.2 78.91 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.575 1.15 . . . . 0.0 111.065 173.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -85.48 -45.77 11.5 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.19 0.596 . . . . 0.0 111.105 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.78 -51.96 35.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.129 0.972 . . . . 0.0 111.878 -170.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -123.51 -4.46 8.26 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.311 0.644 . . . . 0.0 112.176 -173.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.72 12.8 84.12 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-O 120.182 -0.232 . . . . 0.0 113.288 -176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.476 HG12 HG21 ' A' ' 78' ' ' VAL . 57.3 t -86.79 107.13 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.861 0.865 . . . . 0.0 109.406 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 m -136.89 156.33 48.61 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.447 1.099 . . . . 0.0 109.597 -171.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.04 35.25 90.36 Favored Glycine 0 C--N 1.354 1.549 0 O-C-N 123.672 0.607 . . . . 0.0 111.996 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 75' ' ' VAL . 20.5 m -119.62 4.21 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.387 1.075 . . . . 0.0 110.704 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 82' ' ' LEU . 7.1 p-10 -55.83 -37.94 69.38 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.496 1.119 . . . . 0.0 112.656 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.55 -50.93 71.99 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.789 0.681 . . . . 0.0 110.744 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.76 -23.52 64.33 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.921 -178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 79' ' ' ASP . 87.7 mt -73.27 -31.26 63.96 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.551 0.741 . . . . 0.0 111.19 175.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.21 -37.37 85.39 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.522 0.514 . . . . 0.0 109.774 171.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.99 -0.26 30.39 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.014 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 94' ' ' LEU . 79.6 mt -82.17 144.24 30.87 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 169.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.36 -8.44 2.56 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.992 0.917 . . . . 0.0 110.38 174.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.448 HG23 ' HD3' ' A' ' 51' ' ' ARG . 4.2 m -138.96 147.1 41.79 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.97 -31.91 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.676 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 48' ' ' ARG . 38.2 t70 -56.79 -40.62 76.23 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.816 0.846 . . . . 0.0 110.059 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.71 -29.57 64.7 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.979 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.479 ' HB2' ' HE3' ' A' ' 52' ' ' MET . 67.1 tp -64.19 -45.52 87.98 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.218 0.607 . . . . 0.0 111.162 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -58.64 -45.55 89.06 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.682 0.614 . . . . 0.0 109.653 177.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 19.0 mm100 -61.78 -38.59 88.64 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.293 178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -62.68 -61.79 2.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.042 0.937 . . . . 0.0 110.207 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.456 HG13 HG21 ' A' ' 75' ' ' VAL . 92.5 t -60.6 -44.53 97.02 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.129 -172.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -66.45 -35.62 80.73 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -67.36 -38.06 84.19 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.693 0.224 . . . . 0.0 111.475 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -84.34 -17.67 38.71 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.008 0.523 . . . . 0.0 111.981 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -82.3 -48.46 11.17 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.52 37.29 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.61 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 62.84 -167.7 0.21 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.685 1.194 . . . . 0.0 111.09 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -178.41 56.05 0.09 OUTLIER Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.254 1.32 0 C-N-CA 123.447 0.699 . . . . 0.0 109.384 -179.687 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptt? . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.7 34.78 0.03 OUTLIER Glycine 0 C--N 1.345 1.043 0 CA-C-N 116.213 -0.448 . . . . 0.0 113.128 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 66.2 p -76.14 123.75 26.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.26 0.624 . . . . 0.0 109.901 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.2 p -148.91 112.02 4.91 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.258 0.623 . . . . 0.0 109.694 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -132.24 140.05 48.51 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.318 1.047 . . . . 0.0 109.374 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -85.02 -176.7 6.31 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.58 0.752 . . . . 0.0 111.282 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 -152.23 133.86 14.66 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 172.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 p-80 -144.17 120.55 10.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.014 0.526 . . . . 0.0 110.072 177.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -144.76 148.07 33.67 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.282 1.033 . . . . 0.0 108.838 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 p80 -134.48 105.57 6.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.28 0.632 . . . . 0.0 109.396 178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.6 p -80.19 77.66 6.9 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 173.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.8 p -105.45 133.6 49.94 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 124.462 1.105 . . . . 0.0 109.898 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -147.5 165.47 28.72 Favored Glycine 0 C--N 1.34 0.802 0 O-C-N 123.099 0.249 . . . . 0.0 112.804 -177.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -124.7 168.92 12.52 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.236 1.014 . . . . 0.0 109.051 174.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.87 127.44 32.63 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.248 0.619 . . . . 0.0 110.062 175.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -71.4 -62.83 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.044 0.538 . . . . 0.0 110.528 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 mp -105.96 159.48 16.01 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.202 1.001 . . . . 0.0 109.884 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -135.47 174.76 10.25 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.862 1.265 . . . . 0.0 108.458 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -110.29 117.93 34.97 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -80.22 111.47 16.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.23 0.612 . . . . 0.0 109.611 -177.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.45 166.68 40.42 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.973 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -78.74 -68.94 0.6 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.309 1.044 . . . . 0.0 110.067 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 87.8 mtp -141.66 102.78 5.9 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.028 0.931 . . . . 0.0 108.728 177.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -80.22 56.69 6.17 Favored 'Trans proline' 0 C--N 1.372 1.772 0 C-N-CA 123.171 2.58 . . . . 0.0 112.623 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -61.18 -61.85 2.27 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.058 0.943 . . . . 0.0 109.509 178.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -155.42 -78.68 0.09 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.313 169.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.6 ptm -54.77 -35.36 63.71 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -166.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.2 -56.13 16.87 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.36 -35.53 80.59 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.034 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -70.5 -51.66 27.39 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.955 0.902 . . . . 0.0 110.742 -169.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HA ' HG12 ' A' ' 34' ' ' VAL . 4.1 mm? -66.95 -33.76 76.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.331 0.395 . . . . 0.0 110.154 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.5 -32.79 74.58 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 110.588 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' HG23 ' A' ' 37' ' ' VAL . 97.8 m -71.93 -51.32 22.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.427 0.691 . . . . 0.0 111.018 178.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.453 HG12 ' HA ' ' A' ' 31' ' ' LEU . 13.3 p -62.46 -31.65 52.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 122.208 0.203 . . . . 0.0 110.819 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.539 HD11 HD23 ' A' ' 91' ' ' LEU . 87.1 mt -73.16 -34.2 65.9 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.252 0.621 . . . . 0.0 111.439 173.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.6 t -64.64 -36.6 84.77 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.371 0.668 . . . . 0.0 111.12 177.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 33' ' ' THR . 22.0 t -82.77 -25.29 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.517 0.727 . . . . 0.0 110.224 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -74.56 -43.71 54.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.45 0.7 . . . . 0.0 111.453 178.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.8 p -86.94 -50.39 6.71 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.758 0.823 . . . . 0.0 110.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 122.78 -33.04 4.23 Favored Glycine 0 C--N 1.341 0.817 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.007 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.1 m -73.43 130.17 84.54 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 123.006 0.522 . . . . 0.0 111.124 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -54.77 157.53 12.52 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.397 2.731 . . . . 0.0 114.151 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -56.85 -27.4 60.24 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.358 1.063 . . . . 0.0 112.463 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -68.17 -21.37 64.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.757 0.823 . . . . 0.0 111.801 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -105.33 2.98 29.36 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.541 0.737 . . . . 0.0 111.545 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -113.04 120.91 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.293 0.637 . . . . 0.0 109.307 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.6 m -100.85 167.31 10.36 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.318 0.647 . . . . 0.0 109.302 171.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -71.29 -19.41 62.34 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.836 0.35 . . . . 0.0 110.757 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -123.23 79.23 1.65 Allowed 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.4 m -125.08 20.27 8.26 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.549 1.14 . . . . 0.0 108.929 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 56.08 -169.84 0.09 Allowed 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 112.312 -170.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 49.8 ttm -147.24 84.8 1.58 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.577 0.703 . . . . 0.0 109.254 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.36 -4.13 8.37 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.608 174.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -137.18 -36.41 0.66 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.333 0.653 . . . . 0.0 110.63 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 69.6 mt -66.64 -36.85 83.56 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -167.65 79.81 0.18 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.526 0.73 . . . . 0.0 110.142 177.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -147.76 -15.79 0.37 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.468 0.307 . . . . 0.0 111.327 -175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -91.7 150.22 21.24 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.719 0.808 . . . . 0.0 109.338 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -54.04 -45.86 71.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.92 0.888 . . . . 0.0 112.616 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.05 -36.1 74.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.716 0.407 . . . . 0.0 110.551 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.509 HG13 ' HB1' ' A' ' 38' ' ' ALA . 38.4 t -71.3 -40.35 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.214 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 51.3 t -69.81 -39.8 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.915 0.886 . . . . 0.0 110.291 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.488 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 41.5 t -64.37 -46.31 83.92 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.634 0.584 . . . . 0.0 110.264 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -62.19 -43.43 98.86 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.975 0.797 . . . . 0.0 110.563 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.57 -49.34 72.98 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.929 173.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.9 t -65.64 -22.79 66.69 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.159 0.984 . . . . 0.0 112.081 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 63' ' ' SER . 91.1 mt -67.61 -52.12 42.21 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -26.12 61.26 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.36 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.598 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 30.8 mt -67.79 -46.26 72.5 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 174.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -63.28 -42.24 99.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.023 0.929 . . . . 0.0 110.515 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -69.64 -46.4 66.25 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.51 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.33 -49.53 4.22 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.82 -168.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -97.75 -11.64 23.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.377 0.671 . . . . 0.0 111.982 -174.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.02 8.66 86.92 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 123.328 0.392 . . . . 0.0 113.968 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 46.2 t -86.46 108.21 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.35 0.66 . . . . 0.0 110.529 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.0 t -150.31 167.24 27.6 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.99 0.916 . . . . 0.0 109.756 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 24.32 75.14 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 112.046 -0.422 . . . . 0.0 112.046 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 31.6 m -126.09 18.19 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.431 1.092 . . . . 0.0 110.965 -172.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -51.85 -40.92 61.36 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.586 1.154 . . . . 0.0 113.2 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -70.1 -39.41 75.53 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.009 0.924 . . . . 0.0 110.681 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.26 -33.08 71.18 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.394 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.94 -29.84 62.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.715 0.806 . . . . 0.0 111.094 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -73.05 -32.54 65.12 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.969 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.41 -17.86 61.77 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.637 0.775 . . . . 0.0 110.632 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.04 132.96 55.05 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.218 0.607 . . . . 0.0 111.849 177.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.26 -6.55 5.37 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.985 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.6 p -139.94 154.35 47.19 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.412 0.625 . . . . 0.0 111.398 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.4 t -68.58 -40.81 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.771 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.479 ' HA ' ' HD2' ' A' ' 92' ' ' PHE . 9.4 t70 -64.94 -30.21 71.19 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.755 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.26 -41.38 81.16 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.259 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.539 HD23 HD11 ' A' ' 35' ' ' LEU . 59.6 tp -62.63 -42.08 99.39 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 123.464 0.477 . . . . 0.0 111.036 175.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.479 ' HD2' ' HA ' ' A' ' 89' ' ' ASP . 27.0 m-85 -54.57 -48.77 71.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.868 0.467 . . . . 0.0 110.525 177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 79.7 mt-30 -68.96 -37.79 79.03 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.555 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.8 tt -57.46 -55.88 29.04 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.904 0.882 . . . . 0.0 110.2 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.9 t -61.26 -42.55 93.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.491 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -56.67 -42.44 79.01 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.266 0.979 . . . . 0.0 110.771 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 33.4 mmtp -66.64 -47.29 73.04 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.687 0.395 . . . . 0.0 111.737 -178.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -74.96 -18.43 60.39 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.976 0.51 . . . . 0.0 112.043 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -82.64 -55.41 4.47 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.539 0.736 . . . . 0.0 109.955 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.31 -26.69 62.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.751 0.82 . . . . 0.0 111.594 -176.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -106.23 92.78 4.28 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 170.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.81 74.19 1.17 Allowed Glycine 0 C--N 1.348 1.238 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.556 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.1 p . . . . . 0 C--O 1.253 1.253 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 -173.331 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.13 79.73 1.58 Allowed Glycine 0 C--N 1.353 1.484 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -133.37 24.49 4.12 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.689 0.796 . . . . 0.0 110.642 -172.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.1 p -88.46 105.48 17.64 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.121 0.569 . . . . 0.0 110.784 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.4 m170 -79.46 123.13 27.26 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -99.12 149.31 23.18 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -108.7 61.19 0.6 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.949 0.9 . . . . 0.0 109.863 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -68.34 96.73 0.68 Allowed 'General case' 0 C--N 1.352 0.705 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -101.96 125.81 48.72 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.909 0.883 . . . . 0.0 110.384 -176.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -159.97 -33.13 0.06 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.494 1.118 . . . . 0.0 109.291 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.0 m -65.99 114.5 5.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.504 0.722 . . . . 0.0 109.673 172.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -132.08 147.89 52.46 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.481 0.712 . . . . 0.0 110.323 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.62 121.55 22.5 Favored Glycine 0 C--N 1.344 1.001 0 O-C-N 124.271 0.982 . . . . 0.0 112.632 -175.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -84.22 -68.15 0.74 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.681 0.792 . . . . 0.0 109.101 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 52.27 26.89 4.29 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 125.443 1.497 . . . . 0.0 111.445 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -81.48 102.42 10.55 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.163 0.985 . . . . 0.0 109.526 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp 58.77 36.78 24.99 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.242 1.017 . . . . 0.0 111.025 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -87.2 76.69 9.18 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.355 -176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -102.93 103.77 13.93 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.756 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -84.04 -62.92 1.45 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 61.09 -90.68 0.05 OUTLIER Glycine 0 C--N 1.352 1.431 0 O-C-N 124.441 1.088 . . . . 0.0 112.981 177.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -99.77 23.86 9.11 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.212 1.005 . . . . 0.0 111.169 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 tpt -125.97 72.48 70.04 Favored Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 170.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -98.58 -156.84 0.04 OUTLIER 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.557 2.838 . . . . 0.0 112.15 177.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 69.82 -82.73 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.129 1.372 . . . . 0.0 110.389 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.8 t70 9.39 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 128.144 2.578 . . . . 0.0 114.874 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 23.1 ptm -130.31 -45.15 1.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.593 0.757 . . . . 0.0 110.341 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.46 ' HA ' ' CE1' ' A' ' 92' ' ' PHE . 42.9 mt-10 -59.05 -57.15 14.35 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.491 0.716 . . . . 0.0 112.767 -167.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.68 -25.29 67.88 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 123.984 0.803 . . . . 0.0 111.816 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.1 m80 -67.93 -45.41 74.4 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.64 0.587 . . . . 0.0 110.287 171.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 7.4 mp -67.26 -28.93 68.44 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.544 0.337 . . . . 0.0 111.495 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.536 ' HA ' HG21 ' A' ' 46' ' ' ILE . 8.4 mp -63.24 -38.7 92.18 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.696 0.399 . . . . 0.0 109.991 172.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -73.99 -34.11 64.07 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.086 0.866 . . . . 0.0 110.656 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 30' ' ' HIS . 55.4 t -63.06 -58.06 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.141 0.576 . . . . 0.0 110.2 178.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.42 -40.77 97.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.548 0.739 . . . . 0.0 111.455 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.9 p -63.2 -56.9 12.8 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.467 0.479 . . . . 0.0 111.32 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.1 t -67.44 -41.38 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 C-N-CA 123.336 0.654 . . . . 0.0 111.271 -175.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.69 -28.2 68.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.208 0.603 . . . . 0.0 112.145 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.9 m -92.9 -25.63 17.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.968 0.507 . . . . 0.0 111.394 177.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.88 17.15 58.53 Favored Glycine 0 C--N 1.343 0.939 0 C-N-CA 123.001 0.334 . . . . 0.0 112.915 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.4 m -102.11 160.76 25.46 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 124.617 1.167 . . . . 0.0 109.945 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -70.23 158.67 55.62 Favored 'Trans proline' 0 C--N 1.368 1.595 0 C-N-CA 122.323 2.015 . . . . 0.0 112.692 168.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -64.76 -20.01 66.12 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.81 0.844 . . . . 0.0 111.182 173.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.94 -31.52 65.05 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.286 1.034 . . . . 0.0 110.97 173.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -96.4 15.84 20.2 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.99 0.916 . . . . 0.0 111.104 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.536 HG21 ' HA ' ' A' ' 32' ' ' LEU . 21.1 mm -123.46 141.11 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.69 0.796 . . . . 0.0 109.621 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 p -155.43 -168.6 2.88 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.173 0.989 . . . . 0.0 109.706 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.465 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 62.0 mtp85 -75.18 -9.09 58.23 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 176.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -162.71 92.93 0.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 161.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.7 t -106.27 14.13 27.89 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.191 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.685 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 44.8 mmt-85 60.84 104.5 0.02 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 124.37 1.068 . . . . 0.0 111.757 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.49 ' SD ' HD22 ' A' ' 91' ' ' LEU . 71.4 mtm -74.38 -2.16 24.13 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.936 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.685 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 12.7 pt-20 -61.06 -31.41 71.06 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.144 0.578 . . . . 0.0 110.908 173.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -87.51 -39.53 15.09 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.766 0.826 . . . . 0.0 109.986 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.9 mt -81.87 -86.49 0.1 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.724 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -104.44 80.37 1.68 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.497 0.719 . . . . 0.0 110.199 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -145.0 -11.05 0.57 Allowed 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.809 -177.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.45 148.02 26.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -53.8 -40.23 66.16 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.164 0.985 . . . . 0.0 112.638 -174.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -74.39 -39.03 62.94 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.09 0.556 . . . . 0.0 110.708 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 22.7 t -70.9 -37.23 67.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 116.795 -0.184 . . . . 0.0 110.983 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.4 t -68.62 -34.03 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 123.583 0.753 . . . . 0.0 110.011 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.1 t -67.22 -42.15 84.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.876 0.47 . . . . 0.0 110.73 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.86 -23.09 52.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.084 0.954 . . . . 0.0 111.643 177.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.13 -50.28 42.16 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 173.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.5 t -60.96 -41.96 97.35 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.48 1.112 . . . . 0.0 110.772 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 46.0 tp -57.93 -48.87 78.63 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.539 1.136 . . . . 0.0 110.715 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -68.33 -40.85 81.48 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.141 0.976 . . . . 0.0 111.073 -175.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.42 ' HA ' ' HD1' ' A' ' 73' ' ' PHE . 90.1 mt -65.13 -41.57 94.71 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.499 0.72 . . . . 0.0 110.591 179.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -70.59 -34.69 72.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.67 0.788 . . . . 0.0 111.121 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -77.78 -62.74 1.57 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.963 0.505 . . . . 0.0 111.461 -172.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.15 -50.89 17.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.911 0.485 . . . . 0.0 111.836 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' A' ' 69' ' ' LEU . 32.8 m-85 -91.92 -31.02 15.81 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.256 0.623 . . . . 0.0 111.689 -168.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.79 5.79 80.78 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.741 -173.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.632 HG21 HG13 ' A' ' 95' ' ' VAL . 88.3 t -77.11 87.68 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 122.106 0.955 . . . . 0.0 109.638 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.0 m -101.68 162.06 13.19 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 114.063 -1.426 . . . . 0.0 109.928 -177.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.84 38.85 93.26 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 123.503 0.502 . . . . 0.0 113.094 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.481 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 17.4 m -113.89 5.16 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.971 0.909 . . . . 0.0 111.443 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.59 -46.18 84.33 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.855 1.262 . . . . 0.0 112.723 -170.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.48 -37.74 87.72 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.483 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.551 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 7.6 mp0 -66.69 -40.46 88.54 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.615 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 85.3 mt -59.98 -37.13 78.72 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.568 0.747 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.53 -38.63 87.57 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.059 174.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.03 -20.7 59.47 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.26 0.624 . . . . 0.0 111.719 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 95.5 mt -84.09 154.02 23.43 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.443 0.697 . . . . 0.0 112.066 -176.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.521 ' HG3' HG23 ' A' ' 87' ' ' THR . 9.3 pt-20 -136.48 -37.61 0.69 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 109.196 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HG3' ' A' ' 86' ' ' GLU . 11.9 p -102.56 143.28 32.46 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 125.675 1.59 . . . . 0.0 110.538 -173.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.3 t -77.81 -25.81 14.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.173 -173.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -64.81 -39.88 94.3 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.569 0.699 . . . . 0.0 109.854 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.503 ' HA ' HE21 ' A' ' 93' ' ' GLN . 3.9 mp0 -65.47 -36.27 83.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.921 173.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.49 HD22 ' SD ' ' A' ' 52' ' ' MET . 63.7 tp -66.4 -35.25 79.86 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.998 0.519 . . . . 0.0 111.397 172.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.465 ' HE2' ' HA ' ' A' ' 48' ' ' ARG . 21.5 m-85 -66.16 -51.73 55.05 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.285 0.634 . . . . 0.0 110.506 178.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.503 HE21 ' HA ' ' A' ' 90' ' ' GLU . 29.4 pt20 -70.08 -18.51 63.26 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.566 0.347 . . . . 0.0 111.513 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.422 HD22 HD11 ' A' ' 85' ' ' LEU . 64.9 tp -68.99 -47.7 64.92 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.962 0.505 . . . . 0.0 110.614 171.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.632 HG13 HG21 ' A' ' 75' ' ' VAL . 75.9 t -64.56 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.53 0.732 . . . . 0.0 110.229 176.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 93' ' ' GLN . 33.1 tt0 -60.94 -40.8 94.68 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.543 1.137 . . . . 0.0 110.688 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 6.6 tmtt? -63.58 -44.04 95.2 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.301 1.04 . . . . 0.0 109.71 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.8 -24.28 52.81 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.45 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -86.98 -39.05 16.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 123.339 0.399 . . . . 0.0 110.985 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.69 -56.64 4.26 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.461 0.704 . . . . 0.0 109.917 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.11 113.16 22.62 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.82 99.12 0.07 OUTLIER Glycine 0 C--N 1.353 1.496 0 O-C-N 124.441 1.088 . . . . 0.0 113.963 -171.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 C--O 1.245 0.843 0 C-N-CA 123.67 0.788 . . . . 0.0 109.08 178.097 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.6 ttm . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -91.17 -148.86 22.43 Favored Glycine 0 C--N 1.342 0.914 0 N-CA-C 112.332 -0.307 . . . . 0.0 112.332 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 m -148.92 118.88 7.13 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 109.168 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.3 t -143.49 99.52 3.44 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.153 0.581 . . . . 0.0 109.965 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -157.9 150.96 23.03 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 171.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -78.42 139.46 38.74 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -85.27 -19.27 31.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.231 0.612 . . . . 0.0 111.432 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 22.7 t-80 -91.32 11.23 24.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.199 0.599 . . . . 0.0 111.818 -173.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -63.33 102.41 0.4 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.968 0.507 . . . . 0.0 110.121 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -121.89 142.98 49.72 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.979 0.912 . . . . 0.0 110.176 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.7 t -100.38 162.78 12.72 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 123.399 0.68 . . . . 0.0 109.846 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.3 p -81.98 108.84 15.8 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.269 0.628 . . . . 0.0 109.469 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -134.5 -75.21 0.09 OUTLIER Glycine 0 C--N 1.344 1.0 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 52.21 89.12 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.035 1.334 . . . . 0.0 112.158 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.63 145.91 55.48 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.8 0.84 . . . . 0.0 110.681 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -60.0 -33.24 71.71 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 123.941 0.776 . . . . 0.0 110.767 -174.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 tt -123.35 99.66 6.45 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 174.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -119.03 21.79 12.2 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.448 0.699 . . . . 0.0 110.719 -175.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -61.43 -31.79 71.74 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.78 0.832 . . . . 0.0 111.976 -171.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -70.87 143.14 51.13 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.776 0.831 . . . . 0.0 110.265 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.29 -30.3 6.82 Favored Glycine 0 C--N 1.342 0.878 0 N-CA-C 112.11 -0.396 . . . . 0.0 112.11 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -75.41 112.67 11.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.878 0.471 . . . . 0.0 110.155 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.3 ptp -103.0 142.3 24.28 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 168.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -78.03 -4.25 14.22 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.813 2.342 . . . . 0.0 112.214 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 -73.55 89.97 1.73 Allowed 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.053 0.941 . . . . 0.0 109.414 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 29' ' ' ASP . 22.8 t70 -168.66 170.96 9.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.154 0.982 . . . . 0.0 108.776 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 15.1 tpt -84.11 -62.22 1.62 Allowed 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 174.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 92' ' ' PHE . 44.4 mt-10 -62.71 -56.84 14.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.697 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 26' ' ' ASP . 25.3 t70 -58.82 -37.24 75.96 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 124.518 1.136 . . . . 0.0 111.752 -173.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -67.94 -45.45 74.25 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.275 0.63 . . . . 0.0 111.141 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -70.14 -28.62 65.51 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 35' ' ' LEU . 9.4 tp -73.82 -27.04 60.91 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.269 1.028 . . . . 0.0 109.903 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 m -70.32 -42.38 72.0 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.741 0.816 . . . . 0.0 109.606 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.54 -42.95 77.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.313 0.645 . . . . 0.0 110.525 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 32' ' ' LEU . 90.1 mt -67.58 -39.67 84.84 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.11 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 76.4 p -71.6 -29.33 64.57 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.843 0.457 . . . . 0.0 111.191 -176.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -75.15 -40.07 43.77 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 C-N-CA 123.063 0.545 . . . . 0.0 110.312 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.44 -35.55 75.78 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.747 0.819 . . . . 0.0 112.023 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 78.1 p -91.81 -55.6 3.41 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.267 0.627 . . . . 0.0 110.766 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.61 -26.85 5.88 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.072 -175.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.67 148.75 66.34 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.347 0.659 . . . . 0.0 110.408 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.475 ' HD2' ' HG3' ' A' ' 45' ' ' GLU . 76.7 Cg_exo -53.55 159.21 6.73 Favored 'Trans proline' 0 C--N 1.377 2.032 0 C-N-CA 123.396 2.731 . . . . 0.0 113.99 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.4 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 8.8 mtmp? -60.42 -36.42 78.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.986 0.914 . . . . 0.0 110.692 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.02 -8.75 57.97 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.057 0.943 . . . . 0.0 112.046 -177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.475 ' HG3' ' HD2' ' A' ' 42' ' ' PRO . 34.6 mm-40 -90.89 -3.79 57.06 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.647 0.779 . . . . 0.0 110.743 170.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.4 mt -115.45 138.71 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.157 0.983 . . . . 0.0 109.323 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -133.77 161.98 33.23 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.007 0.923 . . . . 0.0 108.667 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.71 -34.6 78.21 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.8 -20.16 60.97 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.926 1.291 . . . . 0.0 112.445 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -74.05 155.99 37.95 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.263 1.025 . . . . 0.0 111.429 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -91.87 176.47 6.51 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.622 0.769 . . . . 0.0 110.326 173.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 55.3 mtt -110.58 111.97 23.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.687 0.795 . . . . 0.0 110.639 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -135.51 -53.33 0.77 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 174.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.95 -38.07 9.14 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.072 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 39' ' ' SER . 56.5 mt -66.28 -43.14 87.21 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.552 -170.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -168.55 84.95 0.17 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.976 0.798 . . . . 0.0 109.901 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -152.56 -48.23 0.1 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.319 0.248 . . . . 0.0 110.54 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.416 ' HB3' HG23 ' A' ' 61' ' ' VAL . 18.3 t70 -62.92 144.14 57.03 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.56 0.538 . . . . 0.0 110.048 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.7 p -55.7 -44.74 77.67 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 111.702 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.88 -40.03 94.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.688 0.795 . . . . 0.0 111.087 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 58' ' ' ASP . 93.1 t -62.81 -43.5 98.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.03 0.532 . . . . 0.0 110.724 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.67 -30.83 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.031 0.933 . . . . 0.0 110.905 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.0 m -66.46 -42.73 87.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.479 0.712 . . . . 0.0 110.108 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.41 -32.56 64.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.163 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.92 -46.18 82.74 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 0.0 110.317 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.0 p -70.61 -30.45 67.11 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.689 0.796 . . . . 0.0 111.028 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.54 -39.11 85.01 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.713 0.805 . . . . 0.0 109.619 173.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 5.9 mptp? -66.49 -44.12 83.53 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 123.521 0.728 . . . . 0.0 109.515 174.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.3 mt -64.0 -27.03 68.84 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.357 0.411 . . . . 0.0 111.259 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -49.49 77.62 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.434 0.693 . . . . 0.0 110.147 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -72.21 -43.39 64.53 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.377 -175.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 15.1 mm-40 -82.61 -52.32 6.92 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.693 0.797 . . . . 0.0 111.102 -168.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -126.31 0.57 7.04 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -171.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 70.47 6.47 58.39 Favored Glycine 0 N--CA 1.478 1.489 0 CA-C-O 119.777 -0.457 . . . . 0.0 114.031 -177.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 90.6 t -80.4 124.2 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.161 0.984 . . . . 0.0 110.674 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.2 m -149.0 155.72 41.21 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.715 0.806 . . . . 0.0 109.798 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.43 -18.2 57.47 Favored Glycine 0 C--N 1.348 1.223 0 CA-C-N 116.421 -0.354 . . . . 0.0 112.518 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.1 m -79.84 8.42 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 124.543 1.137 . . . . 0.0 112.144 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.35 -40.39 61.9 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.745 1.218 . . . . 0.0 112.145 -176.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -65.04 -46.3 81.87 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.978 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -68.66 -28.58 67.01 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.042 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.2 mt -69.59 -37.8 77.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.103 0.961 . . . . 0.0 109.806 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -64.44 -32.25 73.79 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.255 174.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -79.18 -16.45 56.58 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.1 mt -70.75 138.45 50.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.586 0.354 . . . . 0.0 110.205 175.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -125.79 -11.53 6.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.531 0.732 . . . . 0.0 109.581 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.408 ' HB ' ' HG3' ' A' ' 90' ' ' GLU . 2.0 m -135.9 146.91 47.88 Favored 'General case' 0 C--O 1.249 1.044 0 C-N-CA 123.081 0.552 . . . . 0.0 109.979 -175.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.39 -30.32 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.267 -174.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -52.5 -49.12 65.39 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 123.48 0.488 . . . . 0.0 110.459 170.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HB ' ' A' ' 87' ' ' THR . 47.4 mt-10 -61.16 -40.15 92.78 Favored 'General case' 0 C--N 1.35 0.6 0 O-C-N 124.499 1.124 . . . . 0.0 110.877 -176.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.73 -48.66 78.25 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.707 0.63 . . . . 0.0 111.785 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.435 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 9.3 m-85 -58.18 -39.1 78.04 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.485 0.49 . . . . 0.0 110.693 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -77.31 -31.83 54.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.662 0.601 . . . . 0.0 111.46 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.31 -55.38 8.15 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.18 0.592 . . . . 0.0 109.925 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.3 -43.92 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.482 1.113 . . . . 0.0 110.634 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -63.54 -40.93 98.29 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.973 0.796 . . . . 0.0 111.289 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.85 -29.39 66.62 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.201 0.6 . . . . 0.0 111.083 -177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -78.4 -36.97 45.07 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.626 0.77 . . . . 0.0 110.959 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.88 -37.42 55.55 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.512 1.125 . . . . 0.0 110.868 -176.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.76 -46.35 11.49 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.551 0.74 . . . . 0.0 109.902 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 58.83 -164.13 0.21 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 124.754 1.222 . . . . 0.0 112.305 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 122.88 -67.44 0.48 Allowed Glycine 0 C--N 1.348 1.222 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.25 1.102 0 C-N-CA 123.834 0.854 . . . . 0.0 109.336 -179.854 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 129.91 160.5 10.14 Favored Glycine 0 C--N 1.349 1.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.308 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.1 t -163.13 139.65 7.24 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.51 0.724 . . . . 0.0 109.726 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p -79.29 -11.6 59.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.787 0.835 . . . . 0.0 111.262 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 71.32 -176.92 0.2 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.643 1.577 . . . . 0.0 112.009 177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -71.09 155.05 41.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.095 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -141.64 87.32 2.05 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -70.23 119.15 13.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.151 -174.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -121.54 140.89 51.64 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.113 0.965 . . . . 0.0 109.204 176.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -80.73 108.35 14.31 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 25.6 m -87.4 29.32 0.87 Allowed 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.147 0.979 . . . . 0.0 110.924 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 p -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.73 1.212 . . . . 0.0 112.01 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.4 -133.62 0.64 Allowed Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.504 -0.609 . . . . 0.0 111.933 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 59.07 70.72 0.63 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.248 1.019 . . . . 0.0 110.393 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -107.48 12.99 27.31 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.771 1.228 . . . . 0.0 110.454 -177.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -84.0 30.47 0.52 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.78 1.232 . . . . 0.0 112.525 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.9 tp 73.5 145.41 0.08 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.27 1.428 . . . . 0.0 111.352 -179.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -74.44 131.46 41.08 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.764 0.826 . . . . 0.0 110.664 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -63.04 109.12 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.472 0.709 . . . . 0.0 110.618 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.431 ' HA ' ' HB3' ' A' ' 24' ' ' PRO . 1.6 pp0? -128.93 119.79 24.99 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.7 0.8 . . . . 0.0 109.589 176.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.12 59.52 0.84 Allowed Glycine 0 C--N 1.344 1.02 0 N-CA-C 109.965 -1.254 . . . . 0.0 109.965 171.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 65.28 -73.6 0.06 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.4 1.48 . . . . 0.0 109.529 -169.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 mtm -113.46 95.65 36.92 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 168.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.431 ' HB3' ' HA ' ' A' ' 20' ' ' GLN . 70.4 Cg_endo -79.75 53.27 4.66 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 123.414 2.743 . . . . 0.0 113.4 -175.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.432 ' N ' HD22 ' A' ' 25' ' ' ASN . 0.0 OUTLIER -146.36 138.61 25.08 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.749 0.819 . . . . 0.0 109.121 179.069 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.411 ' H ' ' HB3' ' A' ' 29' ' ' ASP . 33.2 t70 -167.5 169.65 11.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -176.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.6 -46.9 80.6 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.18 0.592 . . . . 0.0 110.826 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -61.74 -40.03 93.65 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.29 0.994 . . . . 0.0 110.918 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 26' ' ' ASP . 31.9 t70 -64.4 -43.09 95.49 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 34' ' ' VAL . 40.6 m-70 -69.03 -37.06 78.41 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.638 0.775 . . . . 0.0 110.801 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.2 tp -71.25 -39.39 71.64 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.289 0.636 . . . . 0.0 111.071 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 9.2 mp -69.0 -32.48 72.06 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.843 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.7 m -70.58 -34.35 72.09 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.696 0.399 . . . . 0.0 110.713 173.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 68' ' ' LYS . 20.4 t -56.83 -46.87 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.361 0.664 . . . . 0.0 109.772 172.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.1 mt -68.3 -36.68 79.71 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.962 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.3 p -68.33 -36.16 78.86 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.826 0.45 . . . . 0.0 111.751 -176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.3 -27.63 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.261 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.37 -41.72 63.06 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.162 0.585 . . . . 0.0 111.341 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.3 p -91.2 -63.07 1.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.468 0.707 . . . . 0.0 111.137 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 140.55 -38.58 1.56 Allowed Glycine 0 C--N 1.343 0.971 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -174.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.4 m -68.37 141.91 94.01 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.347 0.659 . . . . 0.0 110.368 175.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.441 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 56.6 Cg_endo -67.08 158.16 58.19 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.795 2.33 . . . . 0.0 111.639 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.745 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 20.5 pttm -68.15 -18.41 64.61 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.24 -31.11 65.2 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 124.226 1.011 . . . . 0.0 111.668 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 15.7 mm-40 -85.57 -23.98 27.41 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.865 0.866 . . . . 0.0 111.502 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -87.16 142.45 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 123.586 0.754 . . . . 0.0 111.051 -172.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.0 t -150.15 177.94 9.44 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.522 1.129 . . . . 0.0 109.195 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.7 mtt-85 -69.86 -24.7 63.47 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.87 0.468 . . . . 0.0 110.599 172.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -65.8 -32.39 73.9 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.102 0.876 . . . . 0.0 110.814 176.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.8 m -60.34 106.64 0.55 Allowed 'General case' 0 C--N 1.357 0.917 0 O-C-N 124.337 1.023 . . . . 0.0 110.551 -177.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.4 mtt-85 -81.4 155.48 25.88 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 169.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.8 mmt -69.68 90.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.789 0.68 . . . . 0.0 109.823 -176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -103.11 -18.09 15.1 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.276 1.03 . . . . 0.0 110.404 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -155.35 -47.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.949 1.3 . . . . 0.0 107.703 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.522 ' H ' HD12 ' A' ' 55' ' ' LEU . 1.6 mp -59.23 122.68 14.45 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.588 172.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.648 ' HB2' HD22 ' A' ' 65' ' ' LEU . . . 53.75 21.88 2.9 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.098 0.959 . . . . 0.0 113.557 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -115.78 19.49 15.16 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 121.774 0.797 . . . . 0.0 111.41 -172.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 61' ' ' VAL . 24.3 t70 -147.79 149.12 31.76 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 172.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.3 p -50.0 -42.65 49.53 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.972 1.309 . . . . 0.0 113.147 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.3 -38.19 74.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 110.87 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.45 HG12 ' H ' ' A' ' 56' ' ' ALA . 25.2 t -76.15 -28.49 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.424 0.69 . . . . 0.0 111.304 -176.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.525 HG13 ' HB2' ' A' ' 82' ' ' LEU . 60.1 t -73.07 -43.26 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 124.096 0.959 . . . . 0.0 109.456 175.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.4 t -60.96 -43.06 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.838 0.711 . . . . 0.0 110.053 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 68' ' ' LYS . 9.9 tp10 -65.65 -38.32 89.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.377 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.648 HD22 ' HB2' ' A' ' 56' ' ' ALA . 45.2 tp -64.23 -45.51 87.89 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 124.143 0.902 . . . . 0.0 110.521 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.6 t -65.44 -44.53 86.98 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.627 0.771 . . . . 0.0 111.292 -177.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 96.6 mt -67.53 -30.89 70.66 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.795 0.838 . . . . 0.0 111.219 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 34' ' ' VAL . 5.5 tppt? -72.84 -46.24 54.02 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 123.79 0.681 . . . . 0.0 109.409 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 98.9 mt -62.73 -32.17 73.23 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.637 174.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -67.28 -30.16 69.95 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.627 1.171 . . . . 0.0 111.803 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -93.4 -48.95 6.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.833 0.453 . . . . 0.0 110.658 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -65.05 -53.86 39.23 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.992 0.807 . . . . 0.0 111.334 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -110.37 -23.5 11.15 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.421 0.688 . . . . 0.0 112.088 -172.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.34 13.91 64.91 Favored Glycine 0 N--CA 1.478 1.477 0 CA-C-N 117.739 0.245 . . . . 0.0 112.837 -172.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.591 HG21 HG13 ' A' ' 95' ' ' VAL . 96.4 t -91.6 115.88 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.41 0.684 . . . . 0.0 110.224 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 15.2 t -149.27 169.68 20.21 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 124.247 1.019 . . . . 0.0 109.598 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.48 -2.79 87.63 Favored Glycine 0 C--N 1.345 1.057 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.564 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.425 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 27.8 m -98.36 17.75 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.699 1.2 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.58 -53.56 29.53 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.296 1.438 . . . . 0.0 112.172 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.15 -39.68 87.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.03 -23.05 61.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.992 0.917 . . . . 0.0 111.233 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HB2' HG13 ' A' ' 62' ' ' VAL . 81.7 mt -71.59 -33.48 69.09 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.404 0.682 . . . . 0.0 110.351 173.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -62.27 -40.23 95.53 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 123.602 0.564 . . . . 0.0 110.795 170.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.85 -24.07 63.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.322 0.649 . . . . 0.0 111.754 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.6 124.82 24.65 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 174.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -117.88 6.21 12.23 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.343 0.657 . . . . 0.0 109.324 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.7 p -145.38 143.44 30.11 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.893 0.877 . . . . 0.0 110.836 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.61 -32.09 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.646 172.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.72 -42.66 97.89 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.186 0.595 . . . . 0.0 111.633 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -27.79 63.63 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.502 0.321 . . . . 0.0 111.193 174.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -63.42 -38.65 91.96 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.346 0.258 . . . . 0.0 110.809 170.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -56.87 -58.44 8.14 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.399 0.679 . . . . 0.0 111.064 176.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -64.52 -29.7 70.73 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.826 0.704 . . . . 0.0 111.489 -177.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.9 -56.71 10.39 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.517 0.511 . . . . 0.0 110.999 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.591 HG13 HG21 ' A' ' 75' ' ' VAL . 96.9 t -59.77 -48.55 87.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 O-C-N 123.73 0.644 . . . . 0.0 110.728 -177.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -65.22 -46.15 81.84 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.575 0.75 . . . . 0.0 112.869 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -65.06 -47.47 77.19 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 120.813 0.339 . . . . 0.0 110.41 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.48 -17.56 60.75 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.126 0.97 . . . . 0.0 111.968 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.555 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -80.79 -46.31 15.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.064 0.545 . . . . 0.0 109.91 176.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.1 -32.38 66.94 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.281 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.48 -158.01 0.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.765 1.226 . . . . 0.0 108.746 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 160.72 -60.8 0.3 Allowed Glycine 0 C--N 1.346 1.088 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.25 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 108.649 178.57 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.88 -163.53 52.07 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.613 0.571 . . . . 0.0 112.419 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.0 t -161.88 108.9 1.36 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.351 0.66 . . . . 0.0 109.659 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.5 t -80.71 121.28 25.69 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.733 0.813 . . . . 0.0 110.04 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -127.54 9.92 6.61 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.006 0.923 . . . . 0.0 109.729 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -83.17 132.65 35.07 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.816 0.847 . . . . 0.0 110.495 -169.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -162.61 178.1 8.84 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.068 0.947 . . . . 0.0 109.169 174.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -102.25 150.06 23.69 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.633 0.373 . . . . 0.0 110.372 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -142.4 41.78 1.62 Allowed 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 171.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -80.71 94.93 6.46 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.433 178.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -107.98 110.07 21.7 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.6 p -158.15 31.14 0.25 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.772 0.829 . . . . 0.0 109.894 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.65 79.7 0.81 Allowed Glycine 0 C--N 1.348 1.246 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.943 -173.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -97.38 106.69 19.05 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 170.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.95 91.44 5.42 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.314 0.578 . . . . 0.0 109.535 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -107.57 124.81 50.48 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.617 ' H ' HD23 ' A' ' 17' ' ' LEU . 1.1 pt? -65.5 90.75 0.11 Allowed 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 121.806 0.812 . . . . 0.0 111.559 -175.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -140.77 154.04 46.11 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.36 1.064 . . . . 0.0 109.356 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -94.15 116.94 29.41 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.289 0.635 . . . . 0.0 109.534 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -91.32 62.53 4.71 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 171.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.04 110.02 3.21 Favored Glycine 0 C--N 1.352 1.461 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.576 -176.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -124.04 -179.77 4.54 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.456 1.102 . . . . 0.0 109.705 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.426 ' SD ' ' N ' ' A' ' 23' ' ' MET . 0.9 OUTLIER -65.32 129.29 94.37 Favored Pre-proline 0 N--CA 1.475 0.808 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.402 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.39 38.23 0.48 Allowed 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 123.805 3.003 . . . . 0.0 114.976 -172.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -74.88 96.83 3.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 162.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -108.26 -179.82 3.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.172 0.989 . . . . 0.0 108.464 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -80.56 -4.91 55.77 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.912 0.885 . . . . 0.0 111.93 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -47.02 -63.2 1.1 Allowed 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -168.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.4 -26.22 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.302 0.641 . . . . 0.0 111.159 -178.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 21.6 m170 -75.52 -35.81 60.67 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.08 0.952 . . . . 0.0 111.018 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -77.73 -34.31 52.62 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.37 -31.43 71.66 Favored 'General case' 0 CA--C 1.559 1.323 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.138 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.3 m -67.53 -41.81 83.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.645 0.778 . . . . 0.0 110.717 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.66 -43.75 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.496 0.719 . . . . 0.0 110.788 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.16 -33.53 76.22 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.495 0.718 . . . . 0.0 111.199 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.2 t -64.38 -36.98 85.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.353 0.661 . . . . 0.0 111.22 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.41 -48.73 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.827 176.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.6 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -67.12 -29.34 69.04 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.161 0.985 . . . . 0.0 112.398 -171.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.407 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 84.5 p -91.15 -52.61 4.74 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.123 0.569 . . . . 0.0 109.518 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.29 -10.44 28.78 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.761 -175.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.403 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -80.61 156.91 72.85 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.212 0.605 . . . . 0.0 110.071 176.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.46 155.9 59.7 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.281 1.987 . . . . 0.0 112.546 172.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -60.27 -23.31 64.03 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.286 1.034 . . . . 0.0 112.077 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -63.53 -38.07 89.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.209 1.003 . . . . 0.0 111.713 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -87.1 -0.9 57.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.451 0.7 . . . . 0.0 112.347 -174.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.56 HG23 HD13 ' A' ' 55' ' ' LEU . 44.1 mt -98.36 137.86 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.166 0.586 . . . . 0.0 109.937 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 t -144.38 151.8 39.79 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.302 0.641 . . . . 0.0 109.367 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.434 ' NH1' ' HB2' ' A' ' 49' ' ' ASP . 5.0 ppt_? -62.78 -30.99 71.88 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 123.765 0.666 . . . . 0.0 109.667 167.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.434 ' HB2' ' NH1' ' A' ' 48' ' ' ARG . 34.5 t70 -83.42 80.22 9.16 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 123.55 0.74 . . . . 0.0 109.148 175.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.4 t -165.27 147.5 7.81 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.698 -177.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -85.82 27.27 0.88 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.292 0.637 . . . . 0.0 110.462 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 15.6 mmt 68.11 36.22 3.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.63 1.172 . . . . 0.0 110.023 -165.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -59.26 88.2 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.39 1.076 . . . . 0.0 111.726 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 64.91 11.33 6.91 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.164 1.385 . . . . 0.0 112.024 -178.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.56 HD13 HG23 ' A' ' 46' ' ' ILE . 83.9 mt -97.02 -40.96 8.6 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.553 0.741 . . . . 0.0 110.925 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.681 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -158.51 -167.15 2.08 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.839 0.856 . . . . 0.0 109.984 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 70.4 t80 81.84 -27.51 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 125.829 1.652 . . . . 0.0 112.098 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.7 136.49 56.87 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.584 0.754 . . . . 0.0 109.947 167.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.0 m -52.61 -44.0 65.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 112.967 -173.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.2 tp -69.73 -38.43 76.87 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.88 0.472 . . . . 0.0 110.818 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.6 HG13 ' HB1' ' A' ' 38' ' ' ALA . 49.1 t -66.86 -37.5 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.711 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.6 t -67.88 -34.38 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 123.343 0.657 . . . . 0.0 110.463 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.1 m -61.85 -49.43 76.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.198 0.599 . . . . 0.0 110.264 175.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -66.91 -37.71 84.86 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.107 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 55.3 tp -68.04 -43.64 78.23 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.774 0.829 . . . . 0.0 110.398 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.2 t -65.48 -43.01 91.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.42 0.688 . . . . 0.0 110.839 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.64 -36.58 84.29 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.124 0.89 . . . . 0.0 110.55 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -70.54 -50.93 32.42 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.334 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 95.7 mt -60.25 -38.38 83.3 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.613 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -59.0 -53.96 52.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.156 0.982 . . . . 0.0 112.17 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -84.91 -62.94 1.42 Allowed 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.818 0.342 . . . . 0.0 110.888 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -65.69 -47.76 74.36 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.008 0.923 . . . . 0.0 112.218 -166.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -91.2 -20.77 21.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.137 0.575 . . . . 0.0 111.813 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.55 0.57 89.38 Favored Glycine 0 C--N 1.352 1.429 0 N-CA-C 113.87 0.308 . . . . 0.0 113.87 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.88 108.82 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 124.286 1.034 . . . . 0.0 109.941 -177.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -133.27 166.47 22.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.155 0.582 . . . . 0.0 110.584 -176.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.29 18.02 79.76 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-N 116.334 -0.394 . . . . 0.0 112.475 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.9 m -110.42 15.79 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.484 1.114 . . . . 0.0 110.614 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.22 -45.24 88.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.709 1.204 . . . . 0.0 111.939 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.402 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 24.7 m-20 -68.35 -36.47 79.28 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.694 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.95 -27.96 64.12 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.188 0.595 . . . . 0.0 111.199 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 99.3 mt -74.32 -26.88 60.43 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.51 0.724 . . . . 0.0 110.853 175.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.11 -37.31 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.184 171.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 80' ' ' ASP . 86.9 mt -84.86 16.35 3.4 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.096 0.958 . . . . 0.0 112.636 -176.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.23 127.32 32.66 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.013 0.435 . . . . 0.0 111.231 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -93.07 -58.65 2.25 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.344 176.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.0 p -119.65 169.34 10.18 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.503 HG22 ' SD ' ' A' ' 52' ' ' MET . 47.6 t -70.07 -33.38 54.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.685 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.64 -40.01 90.38 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.031 0.933 . . . . 0.0 110.611 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -58.78 -43.13 90.33 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.357 1.063 . . . . 0.0 110.54 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 44.0 tp -61.37 -46.09 91.65 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.485 0.714 . . . . 0.0 111.945 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -58.73 -42.96 89.94 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 123.377 0.423 . . . . 0.0 111.081 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.28 -37.53 83.56 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.823 0.449 . . . . 0.0 111.481 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.51 -57.75 10.05 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.374 0.67 . . . . 0.0 110.903 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.15 -35.37 71.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.448 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.98 -45.04 90.82 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.206 1.002 . . . . 0.0 111.473 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -65.57 -41.3 93.09 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.807 -178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -79.97 -17.53 52.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.337 0.655 . . . . 0.0 111.975 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -72.22 -44.88 62.26 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.743 0.817 . . . . 0.0 109.453 174.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.29 -66.26 0.87 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.062 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.01 97.86 6.24 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.283 176.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 154.07 -53.58 0.45 Allowed Glycine 0 N--CA 1.461 0.319 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 CA--C 1.559 1.296 0 C-N-CA 125.089 1.355 . . . . 0.0 111.811 175.474 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.94 152.95 21.32 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 177.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m -75.24 101.11 4.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.511 0.724 . . . . 0.0 109.786 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.9 m -68.31 -50.6 52.36 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.604 0.762 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.8 m80 62.06 105.23 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.778 1.231 . . . . 0.0 111.663 -178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -115.86 146.32 42.11 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.73 0.812 . . . . 0.0 111.644 -174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -148.99 42.77 0.96 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.724 1.209 . . . . 0.0 109.839 176.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.1 73.23 3.68 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 122.074 0.94 . . . . 0.0 111.813 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -94.0 142.08 27.8 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 109.165 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -159.4 140.13 12.43 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 124.117 0.967 . . . . 0.0 108.772 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.7 m -142.5 102.47 4.08 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.262 0.625 . . . . 0.0 109.729 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 m -140.34 99.75 3.73 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.431 1.093 . . . . 0.0 108.372 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -128.42 84.62 0.33 Allowed Glycine 0 C--N 1.34 0.795 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -176.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -147.33 132.34 18.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.37 0.668 . . . . 0.0 110.127 174.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -161.15 128.19 4.08 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 175.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 68.65 162.08 0.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 124.146 0.904 . . . . 0.0 110.799 -173.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 tt 70.97 97.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.891 1.276 . . . . 0.0 108.54 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -109.62 155.45 21.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.713 0.805 . . . . 0.0 109.425 -177.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -72.8 -26.4 61.5 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 123.559 0.537 . . . . 0.0 110.689 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -82.1 -4.81 57.68 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.481 0.713 . . . . 0.0 111.601 175.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.32 -105.57 2.18 Favored Glycine 0 C--N 1.352 1.456 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -174.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -123.67 -61.76 1.36 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -102.31 115.64 64.21 Favored Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 173.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -60.94 176.22 1.04 Allowed 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.2 2.6 . . . . 0.0 113.508 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.72 86.86 0.12 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.674 1.589 . . . . 0.0 110.01 -173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -164.4 144.58 7.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.521 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -106.19 -36.95 6.73 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.604 0.761 . . . . 0.0 109.932 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -65.61 -62.97 1.21 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.391 0.677 . . . . 0.0 112.395 -166.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.85 -34.81 73.61 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.652 0.781 . . . . 0.0 110.85 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -68.58 -35.55 77.53 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.466 0.706 . . . . 0.0 111.636 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.502 HD21 ' HG ' ' A' ' 91' ' ' LEU . 59.2 tp -71.7 -36.6 70.6 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 tp -61.76 -36.93 82.46 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.918 0.887 . . . . 0.0 110.623 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 m -70.43 -40.0 74.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.837 0.855 . . . . 0.0 110.405 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.6 t -60.56 -38.79 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.902 0.881 . . . . 0.0 110.538 176.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 91' ' ' LEU . 95.9 mt -72.62 -33.95 67.01 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.753 0.821 . . . . 0.0 111.287 177.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.1 t -60.85 -38.09 84.34 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.468 0.48 . . . . 0.0 110.694 176.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.3 t -79.61 -37.14 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.686 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.36 -36.56 71.52 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 0.0 111.979 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m -88.7 -40.33 13.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.595 0.758 . . . . 0.0 110.471 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.36 -32.02 7.36 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.0 -175.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.5 m -73.84 143.63 81.6 Favored Pre-proline 0 CA--C 1.556 1.189 0 C-N-CA 123.583 0.753 . . . . 0.0 110.233 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.93 168.9 8.12 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.849 2.366 . . . . 0.0 113.532 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -63.39 -25.71 68.41 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.984 0.913 . . . . 0.0 112.149 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -69.07 -27.91 66.04 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.384 1.074 . . . . 0.0 110.854 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -76.83 -23.09 52.77 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.823 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.578 HG23 HD13 ' A' ' 55' ' ' LEU . 21.2 mt -109.0 144.24 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.749 0.819 . . . . 0.0 110.222 -173.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.7 t -156.07 170.8 21.35 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.012 1.325 . . . . 0.0 108.135 174.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -62.27 -32.66 73.4 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.97 0.508 . . . . 0.0 110.417 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -95.04 -1.65 51.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.421 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.3 m -71.74 -6.15 39.2 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.028 0.531 . . . . 0.0 112.339 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 72.4 mtp85 68.47 170.45 0.28 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.872 1.269 . . . . 0.0 112.638 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.781 ' HG3' ' HB2' ' A' ' 57' ' ' PHE . 44.7 tpp -112.63 90.88 3.46 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.181 -172.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 57' ' ' PHE . 10.3 tp10 -109.84 -68.73 0.9 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.139 0.976 . . . . 0.0 109.921 176.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -116.18 -18.47 10.57 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.95 0.9 . . . . 0.0 110.824 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.578 HD13 HG23 ' A' ' 46' ' ' ILE . 84.3 mt -60.95 -32.75 72.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.268 1.027 . . . . 0.0 112.842 -171.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.504 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -163.37 13.96 0.06 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.393 0.677 . . . . 0.0 112.072 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.781 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 81.6 t80 -100.17 -32.22 11.01 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.538 0.335 . . . . 0.0 110.936 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -55.6 133.43 50.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.901 -0.571 . . . . 0.0 109.568 176.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.8 t -52.95 -37.86 61.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.371 1.069 . . . . 0.0 113.022 -170.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 53.1 tp -68.46 -43.98 75.83 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 123.48 0.488 . . . . 0.0 110.492 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -69.69 -28.53 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 -177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 73.4 t -67.34 -49.14 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.258 0.623 . . . . 0.0 110.241 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.9 m -63.59 -40.14 96.18 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 124.022 0.826 . . . . 0.0 110.718 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -67.14 -41.09 86.66 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.112 0.965 . . . . 0.0 111.051 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.5 HD22 ' HB1' ' A' ' 56' ' ' ALA . 35.0 tp -67.66 -48.87 65.44 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 123.453 0.47 . . . . 0.0 110.209 -175.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.0 t -64.22 -32.71 74.4 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.796 0.438 . . . . 0.0 110.742 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 9.9 tt -63.5 -52.36 61.58 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.243 1.017 . . . . 0.0 109.955 176.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.442 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.1 OUTLIER -74.09 -42.67 59.77 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.572 -173.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.505 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 60.8 mt -61.43 -28.99 69.66 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.823 0.449 . . . . 0.0 111.101 176.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 45.9 ttp180 -57.16 -32.09 66.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.232 1.013 . . . . 0.0 111.681 177.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -97.14 -50.83 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.773 0.829 . . . . 0.0 111.046 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 25.4 mm-40 -62.28 -53.02 61.1 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.379 1.072 . . . . 0.0 112.226 -171.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -120.53 -4.36 9.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.219 0.607 . . . . 0.0 111.822 -173.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.64 20.06 79.77 Favored Glycine 0 C--N 1.351 1.392 0 C-N-CA 123.364 0.507 . . . . 0.0 114.146 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.507 HG21 HG13 ' A' ' 95' ' ' VAL . 51.0 t -90.93 117.41 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.704 0.802 . . . . 0.0 109.532 -177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.8 m -145.41 150.25 36.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.008 0.923 . . . . 0.0 110.672 -171.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.41 15.8 78.96 Favored Glycine 0 C--N 1.359 1.825 0 O-C-N 123.555 0.534 . . . . 0.0 112.861 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.22 8.19 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.328 1.051 . . . . 0.0 111.055 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 3.1 m-20 -54.0 -43.04 69.72 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 125.206 1.403 . . . . 0.0 112.29 -173.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.3 -43.77 96.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 113.765 -1.561 . . . . 0.0 110.051 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 30.5 tt0 -73.43 -28.89 62.22 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.721 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.432 HD23 HD13 ' A' ' 94' ' ' LEU . 93.0 mt -62.8 -37.97 88.82 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.077 0.951 . . . . 0.0 110.265 176.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.29 -39.03 75.1 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.036 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.78 -14.21 62.88 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 94' ' ' LEU . 57.7 mt -70.82 123.2 21.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.887 0.475 . . . . 0.0 110.451 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' HG3' HG23 ' A' ' 87' ' ' THR . 10.7 pt-20 -93.12 -22.78 18.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.583 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.501 HG23 ' HG3' ' A' ' 86' ' ' GLU . 67.5 p -133.81 159.14 41.53 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.571 0.748 . . . . 0.0 111.122 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 t -69.22 -26.89 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.116 174.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 93' ' ' GLN . 33.0 t70 -61.11 -43.91 98.16 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.191 0.596 . . . . 0.0 110.408 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HB3' HD22 ' A' ' 85' ' ' LEU . 74.0 mm-40 -60.62 -32.38 71.52 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 123.882 0.739 . . . . 0.0 111.545 172.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.533 HD21 HD21 ' A' ' 35' ' ' LEU . 34.0 tp -67.83 -41.41 83.07 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 175.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -60.8 -40.37 92.42 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.956 0.408 . . . . 0.0 109.927 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 89' ' ' ASP . 76.7 mt-30 -64.1 -40.41 96.17 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.117 174.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 85' ' ' LEU . 6.1 tt -59.64 -49.94 75.8 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.264 1.026 . . . . 0.0 110.907 -176.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.507 HG13 HG21 ' A' ' 75' ' ' VAL . 63.3 t -62.87 -50.81 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -65.11 -24.26 67.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 123.816 0.698 . . . . 0.0 112.435 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -67.33 -51.59 50.57 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.24 1.016 . . . . 0.0 109.854 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -82.49 -16.56 48.32 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.402 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -41.4 28.25 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.22 1.008 . . . . 0.0 109.33 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -78.35 -51.78 9.59 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.47 0.708 . . . . 0.0 110.677 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.54 97.66 9.7 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -150.4 37.3 0.91 Allowed Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.795 -0.522 . . . . 0.0 111.795 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.5 m . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 123.427 0.691 . . . . 0.0 109.505 178.568 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.7 mtp . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.46 50.12 6.85 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 123.756 0.66 . . . . 0.0 113.703 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.6 m -69.44 98.91 1.16 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.474 0.709 . . . . 0.0 109.975 176.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.9 t -87.58 87.65 7.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.652 0.781 . . . . 0.0 109.657 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.5 m-70 -123.51 74.11 1.23 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 175.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -134.36 24.07 3.78 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.04 0.936 . . . . 0.0 110.23 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -77.0 97.97 4.82 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.304 1.042 . . . . 0.0 110.373 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -123.09 127.87 49.33 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.54 1.136 . . . . 0.0 108.099 177.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.2 p-80 -69.47 110.03 4.54 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.498 0.666 . . . . 0.0 110.168 -179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -86.56 87.84 7.53 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.3 p -66.69 122.13 16.96 Favored 'General case' 0 C--N 1.352 0.675 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.081 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.2 m -106.8 151.23 25.46 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 123.63 0.772 . . . . 0.0 109.97 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.92 77.54 1.3 Allowed Glycine 0 C--N 1.348 1.23 0 O-C-N 123.808 0.692 . . . . 0.0 111.789 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.646 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 19.2 mmt180 -121.26 103.83 9.28 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.506 1.123 . . . . 0.0 109.703 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -64.24 99.68 0.29 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 0.0 111.231 -177.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 65.02 10.65 6.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.615 1.166 . . . . 0.0 112.839 175.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.646 ' HB2' ' HB3' ' A' ' 14' ' ' ARG . 88.3 mt -93.18 57.29 2.68 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.719 0.771 . . . . 0.0 109.351 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -150.47 69.11 0.98 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.353 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -68.75 -39.5 80.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.397 -1.274 . . . . 0.0 109.954 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -142.95 139.43 30.69 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.086 0.554 . . . . 0.0 110.008 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.7 -78.9 0.17 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -167.22 124.3 1.2 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.438 1.095 . . . . 0.0 108.877 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -86.61 144.92 38.25 Favored Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -52.5 128.03 26.39 Favored 'Trans proline' 0 C--N 1.38 2.225 0 C-N-CA 123.202 2.601 . . . . 0.0 112.94 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.519 HD22 ' H ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -103.09 23.3 12.55 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.313 0.645 . . . . 0.0 110.445 178.131 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.25 167.55 17.56 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.497 1.119 . . . . 0.0 110.921 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 25.0 ptm -60.65 -28.38 68.52 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.007 0.923 . . . . 0.0 111.767 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HA ' ' HE1' ' A' ' 92' ' ' PHE . 51.3 mt-10 -59.93 -53.03 62.69 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 123.347 0.659 . . . . 0.0 110.492 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.83 -34.79 78.97 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.241 -179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -64.11 -38.26 90.43 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.409 0.683 . . . . 0.0 111.867 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HG21 ' A' ' 95' ' ' VAL . 58.3 mt -69.16 -38.55 78.79 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.175 0.512 . . . . 0.0 111.016 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tp -67.86 -37.39 81.77 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.952 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.6 m -76.13 -37.51 57.93 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.653 1.181 . . . . 0.0 110.936 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' HA ' ' A' ' 31' ' ' LEU . 11.7 p -68.96 -35.4 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 117.78 0.264 . . . . 0.0 110.614 -176.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.406 HD22 ' HB2' ' A' ' 56' ' ' ALA . 91.0 mt -67.64 -39.74 84.6 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.543 173.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.1 t -59.65 -51.73 68.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.678 0.791 . . . . 0.0 111.733 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.4 t -71.04 -45.8 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 123.958 0.903 . . . . 0.0 111.335 -174.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.67 -36.32 80.48 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.045 0.538 . . . . 0.0 111.627 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.6 m -85.93 -15.89 40.21 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.933 0.493 . . . . 0.0 111.666 178.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.02 6.73 89.02 Favored Glycine 0 C--N 1.352 1.468 0 C-N-CA 122.739 0.209 . . . . 0.0 113.495 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.752 HG21 HD23 ' A' ' 55' ' ' LEU . 27.1 m -88.44 161.52 42.37 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 124.923 1.289 . . . . 0.0 111.003 -178.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.23 149.03 92.11 Favored 'Trans proline' 0 C--N 1.367 1.529 0 C-N-CA 122.416 2.077 . . . . 0.0 111.36 162.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -70.04 -19.26 63.31 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.239 0.616 . . . . 0.0 110.53 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.37 -27.46 64.25 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.132 0.973 . . . . 0.0 112.65 172.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.83 -16.85 61.6 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.89 0.876 . . . . 0.0 111.454 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.5 mt -120.13 125.19 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.666 0.786 . . . . 0.0 111.081 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.3 t -125.8 177.11 6.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.438 1.095 . . . . 0.0 108.066 168.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -68.52 -39.08 81.34 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 122.559 0.344 . . . . 0.0 110.982 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.36 -3.68 58.44 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.8 0.84 . . . . 0.0 112.025 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -72.36 164.69 25.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.229 0.612 . . . . 0.0 111.986 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.653 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 0.0 OUTLIER -110.38 132.39 54.22 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.377 0.608 . . . . 0.0 110.361 173.355 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 24.9 ptp -80.68 67.71 6.65 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 122.339 1.066 . . . . 0.0 109.104 171.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -86.14 -70.77 0.58 Allowed 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.54 -30.99 67.88 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 172.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.752 HD23 HG21 ' A' ' 41' ' ' VAL . 2.7 mp -91.07 140.52 29.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.592 1.157 . . . . 0.0 108.965 -173.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.462 ' HB3' ' HB2' ' A' ' 52' ' ' MET . . . 74.61 -37.32 0.35 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 170.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -63.53 -29.35 70.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.673 1.189 . . . . 0.0 113.726 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -55.11 135.88 48.75 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.491 0.717 . . . . 0.0 110.7 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.5 m -60.84 -33.08 72.5 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -171.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.9 tp -70.17 -37.83 75.28 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.193 0.597 . . . . 0.0 109.964 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -72.57 -38.03 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.839 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.5 t -65.19 -34.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 C-N-CA 123.807 0.843 . . . . 0.0 110.328 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.4 t -62.68 -49.13 76.31 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.288 0.635 . . . . 0.0 109.82 178.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 9.1 tp10 -67.33 -41.88 84.53 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.172 0.589 . . . . 0.0 110.513 178.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.56 -44.46 96.99 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.678 1.191 . . . . 0.0 111.147 -177.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.6 p -65.79 -36.17 82.76 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.667 0.787 . . . . 0.0 110.991 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 96.9 mt -63.92 -40.6 96.85 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.913 0.758 . . . . 0.0 111.097 173.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 75.1 mmtt -67.58 -44.04 79.11 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.002 0.521 . . . . 0.0 111.076 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.5 mt -67.32 -35.68 79.91 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.582 0.353 . . . . 0.0 110.172 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -60.69 -39.37 88.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.958 1.303 . . . . 0.0 111.419 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' LEU . 74.2 mmtt -91.64 -68.06 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.926 0.49 . . . . 0.0 110.773 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -63.0 -42.66 99.91 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.249 1.02 . . . . 0.0 112.472 -169.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -98.08 -20.98 17.03 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.147 0.579 . . . . 0.0 111.041 -178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.89 -7.92 68.42 Favored Glycine 0 C--N 1.353 1.515 0 CA-C-O 119.893 -0.393 . . . . 0.0 113.16 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.449 HG21 HG13 ' A' ' 95' ' ' VAL . 68.9 t -75.75 98.4 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 124.534 1.133 . . . . 0.0 110.021 -175.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.7 m -109.17 154.86 21.76 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.485 1.114 . . . . 0.0 110.271 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.37 20.32 72.32 Favored Glycine 0 C--N 1.351 1.409 0 C-N-CA 123.251 0.453 . . . . 0.0 113.392 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.437 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 m -108.96 16.08 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 123.639 0.776 . . . . 0.0 110.982 -177.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.48 -56.89 14.96 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.099 1.359 . . . . 0.0 111.292 -175.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.33 -34.97 79.38 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.679 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -68.09 -30.69 69.92 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.636 0.775 . . . . 0.0 110.528 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 96.6 mt -70.4 -39.69 74.34 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.081 0.952 . . . . 0.0 110.96 176.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.62 -35.41 76.1 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.852 173.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.92 -19.99 53.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.5 0.72 . . . . 0.0 112.19 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.541 HD11 HD13 ' A' ' 94' ' ' LEU . 69.8 mt -67.88 138.65 56.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 117.95 0.341 . . . . 0.0 111.398 176.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -119.54 -38.07 3.05 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 123.364 0.665 . . . . 0.0 109.601 177.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 50.8 p -108.19 148.06 30.46 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 122.119 0.961 . . . . 0.0 112.164 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.452 HG12 ' CE2' ' A' ' 92' ' ' PHE . 34.0 t -65.71 -30.11 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 113.987 -1.46 . . . . 0.0 109.834 176.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.4 -46.49 80.15 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.067 0.947 . . . . 0.0 111.169 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.02 -32.99 74.73 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.264 176.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.98 -48.64 79.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 123.639 0.587 . . . . 0.0 111.902 174.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.452 ' CE2' HG12 ' A' ' 88' ' ' VAL . 64.3 m-85 -56.29 -45.09 80.33 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.235 0.614 . . . . 0.0 110.902 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' A' ' 97' ' ' LYS . 48.6 mt-30 -64.52 -49.24 72.07 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.944 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.541 HD13 HD11 ' A' ' 85' ' ' LEU . 8.5 tt -51.72 -57.85 8.08 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.053 1.341 . . . . 0.0 110.378 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.495 HG21 HD21 ' A' ' 31' ' ' LEU . 70.8 t -58.84 -38.75 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.657 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -68.5 -36.25 78.64 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.17 0.588 . . . . 0.0 111.906 179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 34.3 mmtp -66.49 -39.26 88.64 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.214 0.606 . . . . 0.0 110.127 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.455 ' HA ' ' HA3' ' A' ' 102' ' ' GLY . 86.8 m-70 -78.62 -24.69 45.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.134 0.574 . . . . 0.0 111.208 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -77.62 -32.31 53.37 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.362 0.665 . . . . 0.0 110.64 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.56 -62.12 1.32 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.674 0.79 . . . . 0.0 111.105 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -103.43 -9.4 19.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.638 -171.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 98' ' ' HIS . . . -100.12 46.17 1.41 Allowed Glycine 0 N--CA 1.474 1.23 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 -176.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--O 1.249 1.034 0 C-N-CA 123.842 0.857 . . . . 0.0 110.383 179.489 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 ttm . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.98 -127.67 9.3 Favored Glycine 0 C--N 1.348 1.243 0 N-CA-C 111.96 -0.456 . . . . 0.0 111.96 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.5 m -136.75 100.15 4.24 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.922 0.889 . . . . 0.0 109.751 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 58.6 p -80.13 114.51 19.09 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 174.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.2 m80 -86.52 -86.91 0.14 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 59.93 20.28 9.28 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.416 1.086 . . . . 0.0 113.44 169.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -110.8 173.42 6.34 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.579 0.751 . . . . 0.0 110.456 -177.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -148.66 131.73 16.3 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 108.433 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -85.66 -19.9 30.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.016 0.526 . . . . 0.0 111.401 -176.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 59.74 86.74 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.509 1.124 . . . . 0.0 110.579 -176.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.1 p -79.04 74.33 5.58 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.409 0.684 . . . . 0.0 110.593 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.6 t -176.4 161.82 2.27 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.975 1.31 . . . . 0.0 108.849 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.73 -72.53 0.13 Allowed Glycine 0 C--N 1.339 0.702 0 N-CA-C 111.879 -0.488 . . . . 0.0 111.879 177.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -131.05 155.75 46.36 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.484 0.714 . . . . 0.0 111.019 -174.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -158.77 88.52 0.91 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.225 1.01 . . . . 0.0 109.516 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -71.53 -56.46 5.85 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 66.2 tp -123.91 -40.61 2.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 172.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 18.2 t80 67.16 21.26 10.09 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.848 1.259 . . . . 0.0 110.602 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 62.38 25.19 15.03 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.938 1.295 . . . . 0.0 111.59 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -82.87 98.45 9.18 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 123.323 0.649 . . . . 0.0 109.521 -177.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.04 -102.05 1.4 Allowed Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.068 175.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -145.57 168.83 19.69 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.925 0.89 . . . . 0.0 110.827 -176.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 59.9 mtm -84.82 151.77 58.47 Favored Pre-proline 0 CA--C 1.549 0.935 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.23 173.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.19 85.11 0.26 Allowed 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 122.395 2.063 . . . . 0.0 111.531 174.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.38 93.24 9.46 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.051 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -166.1 143.13 5.24 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.161 0.584 . . . . 0.0 111.404 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 tmm? 40.63 -80.08 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 127.252 2.221 . . . . 0.0 113.151 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.47 ' O ' HD22 ' A' ' 32' ' ' LEU . 35.5 mt-10 -53.82 -48.63 69.72 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 123.941 0.896 . . . . 0.0 111.122 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.06 -47.05 78.67 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.159 0.912 . . . . 0.0 111.28 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.445 ' O ' HG23 ' A' ' 34' ' ' VAL . 55.4 t60 -73.19 -25.95 60.98 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.619 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.46 -40.02 85.33 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HB3' ' HB2' ' A' ' 43' ' ' LYS . 0.9 OUTLIER -60.89 -40.48 93.22 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.513 0.325 . . . . 0.0 110.202 171.435 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -63.59 -37.99 89.41 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.556 0.742 . . . . 0.0 110.978 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 30' ' ' HIS . 61.1 t -62.61 -50.75 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 122.801 0.441 . . . . 0.0 109.852 177.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.74 -42.33 95.27 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 122.697 0.399 . . . . 0.0 111.593 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.2 p -64.69 -39.6 93.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.563 0.745 . . . . 0.0 111.96 -174.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.56 -31.33 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.293 175.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.97 -7.71 59.04 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 0.0 112.509 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -112.31 -61.54 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.426 0.69 . . . . 0.0 109.987 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.12 -34.42 2.26 Favored Glycine 0 C--N 1.341 0.84 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.292 -173.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.19 154.87 92.08 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 123.19 0.596 . . . . 0.0 111.1 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -55.23 152.57 30.75 Favored 'Trans proline' 0 C--N 1.377 2.026 0 C-N-CA 123.008 2.472 . . . . 0.0 113.27 168.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.594 ' HB2' ' HB3' ' A' ' 32' ' ' LEU . 21.4 ptmt -69.71 -22.81 63.37 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.599 0.76 . . . . 0.0 111.817 -179.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -73.21 -25.4 60.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.336 0.654 . . . . 0.0 110.505 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -72.95 -18.58 61.37 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.446 0.698 . . . . 0.0 111.593 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.0 mt -102.19 124.23 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 123.312 0.645 . . . . 0.0 109.704 -177.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -133.42 -179.88 5.79 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.297 1.039 . . . . 0.0 108.723 175.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.497 ' HB3' ' HB2' ' A' ' 89' ' ' ASP . 5.5 mpt_? -58.85 -55.12 39.2 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.004 0.922 . . . . 0.0 111.585 -172.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -90.47 3.92 52.53 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 0.0 112.343 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.5 m -74.48 -0.76 18.55 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HA ' ' HA ' ' A' ' 87' ' ' THR . 49.7 mtt180 66.81 170.74 0.25 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 112.259 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.75 ' SD ' HD22 ' A' ' 91' ' ' LEU . 72.5 mtm -116.45 29.54 7.89 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.231 1.013 . . . . 0.0 108.973 168.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.98 -55.83 30.11 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.207 0.942 . . . . 0.0 110.795 -172.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -101.72 16.21 26.53 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.972 0.909 . . . . 0.0 110.568 177.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 74.4 mt -114.34 -68.14 0.95 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.842 0.457 . . . . 0.0 111.615 -171.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 52' ' ' MET . . . -112.24 -21.4 11.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -173.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -70.6 89.65 0.73 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.162 0.585 . . . . 0.0 110.32 -176.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -177.62 146.97 0.48 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.616 1.566 . . . . 0.0 108.213 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -56.49 -46.6 80.41 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.386 0.674 . . . . 0.0 112.049 -177.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.1 mp -74.41 -37.84 63.24 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.022 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -79.19 -32.8 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.218 0.324 . . . . 0.0 111.736 -175.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.5 -37.42 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 171.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 70.7 m -67.25 -37.28 83.24 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.013 0.525 . . . . 0.0 111.272 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.43 -37.2 65.94 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.7 tp -66.68 -48.11 70.34 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 178.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.494 ' HB3' HD12 ' A' ' 82' ' ' LEU . 40.8 p -66.62 -33.23 75.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.216 0.607 . . . . 0.0 111.665 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 56.2 tp -69.31 -40.4 77.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.348 0.659 . . . . 0.0 110.516 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -71.99 -42.09 66.87 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.392 0.677 . . . . 0.0 110.39 -177.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 93.3 mt -66.57 -38.55 87.31 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.052 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -55.27 -45.08 76.16 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.582 1.153 . . . . 0.0 111.516 177.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.7 -66.51 0.69 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.762 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.94 -54.49 6.5 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.043 -165.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -89.5 -11.68 42.23 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.454 -174.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.57 -7.6 53.03 Favored Glycine 0 C--N 1.355 1.612 0 C-N-CA 123.836 0.731 . . . . 0.0 114.393 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.455 ' HB ' ' HB3' ' A' ' 69' ' ' LEU . 48.5 t -77.56 102.79 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.84 0.856 . . . . 0.0 110.777 -171.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 t -137.32 169.36 17.92 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.695 0.798 . . . . 0.0 110.313 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.01 14.62 78.7 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.538 -176.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG21 HG12 ' A' ' 75' ' ' VAL . 35.7 m -119.91 16.17 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.429 1.092 . . . . 0.0 111.274 -173.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -54.94 -44.76 74.58 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.04 0.936 . . . . 0.0 112.216 -173.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -67.07 -34.09 76.92 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.458 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.3 mp0 -67.43 -38.5 84.66 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.668 0.605 . . . . 0.0 110.381 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 66' ' ' SER . 97.7 mt -63.91 -31.47 72.66 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.333 0.653 . . . . 0.0 111.197 178.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -75.1 -35.02 61.8 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.512 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -69.84 -23.46 63.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.631 0.772 . . . . 0.0 111.384 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.602 HD11 HD13 ' A' ' 94' ' ' LEU . 95.1 mt -76.31 118.11 18.68 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 122.938 0.495 . . . . 0.0 110.475 178.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.87 -13.76 19.92 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.682 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -137.55 144.09 41.91 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 124.086 0.954 . . . . 0.0 111.477 -168.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.7 t -75.23 -23.66 17.2 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.06 -171.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.497 ' HB2' ' HB3' ' A' ' 48' ' ' ARG . 31.7 t70 -59.62 -50.06 75.36 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.452 0.644 . . . . 0.0 110.239 178.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -68.02 -31.56 71.32 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.319 -1.31 . . . . 0.0 110.556 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.75 HD22 ' SD ' ' A' ' 52' ' ' MET . 52.5 tp -64.33 -47.29 79.92 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 123.406 0.441 . . . . 0.0 111.586 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -56.73 -45.96 81.64 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.599 0.76 . . . . 0.0 109.881 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.78 -34.06 74.92 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.863 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.602 HD13 HD11 ' A' ' 85' ' ' LEU . 9.4 tt -70.32 -47.03 62.96 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.62 -48.69 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 123.42 0.688 . . . . 0.0 110.057 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.71 -36.34 80.45 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.602 0.761 . . . . 0.0 111.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -64.43 -48.65 74.54 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.306 0.642 . . . . 0.0 110.5 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -77.37 -18.45 57.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.695 0.798 . . . . 0.0 111.499 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -78.44 -46.46 19.73 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.482 0.713 . . . . 0.0 110.282 176.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.51 -62.27 1.58 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.36 0.664 . . . . 0.0 109.901 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -81.6 78.32 8.35 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.907 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -118.88 19.77 10.17 Favored Glycine 0 C--N 1.343 0.92 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.359 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 23.8 p . . . . . 0 CA--C 1.556 1.208 0 C-N-CA 123.973 0.909 . . . . 0.0 110.349 -179.572 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 mtm . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.85 -159.33 20.85 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 111.436 -0.665 . . . . 0.0 111.436 -174.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p 51.34 78.87 0.1 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.18 1.392 . . . . 0.0 112.219 -175.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.7 p -73.76 97.32 2.69 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.283 176.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.5 p80 -62.46 -34.98 77.88 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.287 0.635 . . . . 0.0 110.849 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.6 t70 65.67 157.86 0.1 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.558 1.543 . . . . 0.0 111.456 -178.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.627 ' HE1' HG12 ' A' ' 37' ' ' VAL . 11.5 t-80 -72.82 -58.65 3.18 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 122.973 0.509 . . . . 0.0 110.129 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 54.59 83.2 0.08 Allowed 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.63 1.172 . . . . 0.0 113.564 170.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -117.66 123.71 46.79 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 172.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -113.67 74.48 0.87 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 174.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.6 m -86.59 83.21 7.66 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.387 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.6 p -140.09 165.14 28.16 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.734 0.814 . . . . 0.0 110.031 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.96 -109.33 0.89 Allowed Glycine 0 C--N 1.342 0.881 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -88.25 88.86 7.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.169 0.588 . . . . 0.0 109.841 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.7 142.39 27.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.916 0.887 . . . . 0.0 109.414 176.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -109.18 144.5 37.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.172 0.589 . . . . 0.0 110.576 -176.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.98 164.49 26.56 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.753 0.821 . . . . 0.0 111.08 176.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -90.54 171.4 9.43 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.933 0.893 . . . . 0.0 110.665 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -98.87 -44.79 6.22 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.866 0.866 . . . . 0.0 109.104 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -139.26 145.21 38.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.048 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.17 -74.74 0.25 Allowed Glycine 0 C--N 1.344 1.005 0 N-CA-C 111.504 -0.639 . . . . 0.0 111.504 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 63.3 14.06 7.52 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.012 1.325 . . . . 0.0 112.063 -175.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.6 ttt -162.59 80.66 1.74 Allowed Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.25 1.02 . . . . 0.0 108.418 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -85.46 -179.36 3.42 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.378 2.052 . . . . 0.0 111.539 173.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.2 t30 66.42 6.45 4.34 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.805 1.242 . . . . 0.0 112.015 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -92.26 147.66 22.75 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 118.111 -0.947 . . . . 0.0 109.124 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.45 ' SD ' ' NH1' ' A' ' 99' ' ' ARG . 20.1 ttt -18.9 -60.04 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 C-N-CA 127.427 2.291 . . . . 0.0 116.324 -169.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.87 -58.73 6.39 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.121 0.568 . . . . 0.0 110.555 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -62.09 -31.55 72.01 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.669 0.606 . . . . 0.0 111.17 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.425 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.1 t60 -71.91 -31.68 66.63 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.63 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.3 -37.56 85.69 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.896 0.478 . . . . 0.0 109.713 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -65.09 -35.9 82.61 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.751 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.5 m -66.53 -41.66 88.44 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.238 0.615 . . . . 0.0 110.069 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 30' ' ' HIS . 43.9 t -58.76 -47.04 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.069 0.948 . . . . 0.0 110.294 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' HD23 ' A' ' 55' ' ' LEU . 98.2 mt -68.35 -37.69 80.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.342 178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.7 t -64.6 -39.52 93.87 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.085 0.954 . . . . 0.0 111.253 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.627 HG12 ' HE1' ' A' ' 7' ' ' HIS . 65.7 t -78.7 -30.54 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.379 0.672 . . . . 0.0 110.201 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.93 -25.95 53.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.316 0.646 . . . . 0.0 112.156 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.5 p -108.26 -66.11 1.07 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.002 0.521 . . . . 0.0 110.151 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 138.06 -27.04 2.81 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-O 119.847 -0.418 . . . . 0.0 112.163 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -70.05 131.66 88.85 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.967 0.507 . . . . 0.0 110.813 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.66 158.82 26.53 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 123.304 2.669 . . . . 0.0 112.478 176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -63.12 -21.1 65.96 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.719 0.808 . . . . 0.0 112.51 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -65.83 -26.16 67.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.765 0.826 . . . . 0.0 111.335 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -100.29 8.27 43.84 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.885 0.874 . . . . 0.0 111.914 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 HD21 ' A' ' 55' ' ' LEU . 38.4 mt -113.14 140.08 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.188 0.595 . . . . 0.0 109.876 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -151.55 173.33 14.75 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.517 1.127 . . . . 0.0 109.366 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -30.25 69.92 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.463 0.649 . . . . 0.0 110.0 169.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.39 15.58 10.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.526 1.13 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.486 ' HB3' HG21 ' A' ' 88' ' ' VAL . 47.9 t -70.22 -21.38 63.02 Favored 'General case' 0 C--N 1.358 0.976 0 O-C-N 122.052 -0.405 . . . . 0.0 110.452 171.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 56.45 23.18 7.19 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.834 1.253 . . . . 0.0 113.404 169.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.638 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 14.3 mmt 60.4 54.58 3.82 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.195 0.998 . . . . 0.0 111.928 176.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 50' ' ' SER . 20.0 mm-40 -68.8 -71.31 0.22 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.179 0.514 . . . . 0.0 110.208 177.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -104.03 -19.99 14.01 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.915 1.286 . . . . 0.0 109.837 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 35' ' ' LEU . 4.4 mp -93.15 133.12 36.65 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.21 1.004 . . . . 0.0 110.357 -168.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.638 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 68.38 -69.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.861 1.664 . . . . 0.0 112.051 176.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.578 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 43.9 t80 -56.79 90.84 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.342 1.457 . . . . 0.0 111.776 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.1 t70 176.14 146.47 0.09 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 106.513 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 56.2 p -56.84 -45.48 82.34 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.054 0.542 . . . . 0.0 112.271 -175.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 58.6 tp -70.37 -49.08 52.92 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.279 0.632 . . . . 0.0 110.867 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 18.5 t -71.53 -26.45 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 123.43 0.457 . . . . 0.0 111.322 -172.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.91 -43.96 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.506 0.722 . . . . 0.0 109.646 172.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.1 m -62.27 -36.5 82.25 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.468 0.651 . . . . 0.0 111.122 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 25.6 tt0 -75.22 -37.84 60.93 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.306 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 35.1 tp -65.47 -28.45 69.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.319 0.648 . . . . 0.0 110.673 176.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 58.2 m -63.07 -49.48 74.36 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.097 0.959 . . . . 0.0 110.553 175.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -75.19 -19.94 59.56 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-O 119.217 -0.421 . . . . 0.0 112.126 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.551 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 72.9 mmtt -64.43 -62.88 1.32 Allowed 'General case' 0 C--N 1.367 1.365 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.63 -30.46 69.88 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.524 1.129 . . . . 0.0 111.802 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -52.9 -49.24 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.913 1.285 . . . . 0.0 110.451 173.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -91.42 -24.5 19.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.52 0.728 . . . . 0.0 111.722 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -85.64 -52.98 5.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.821 0.848 . . . . 0.0 111.571 -166.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -117.58 -2.19 11.52 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.365 0.666 . . . . 0.0 110.848 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.5 -3.88 83.56 Favored Glycine 0 C--N 1.353 1.515 0 C-N-CA 122.992 0.329 . . . . 0.0 113.409 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.411 HG12 HG22 ' A' ' 78' ' ' VAL . 13.0 t -89.36 98.44 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.8 t -80.17 143.66 33.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.177 0.591 . . . . 0.0 112.336 -169.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.32 -87.22 0.5 Allowed Glycine 0 C--N 1.351 1.377 0 O-C-N 124.287 0.992 . . . . 0.0 112.872 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.584 HG12 ' HB3' ' A' ' 81' ' ' GLU . 3.5 t 62.3 21.93 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 C-N-CA 124.518 1.127 . . . . 0.0 110.032 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.07 -41.22 74.77 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.814 1.246 . . . . 0.0 112.663 -168.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -62.08 -44.87 95.73 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 123.875 0.734 . . . . 0.0 111.009 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.584 ' HB3' HG12 ' A' ' 78' ' ' VAL . 8.4 tp10 -72.61 -47.88 44.15 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.186 -175.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.87 -30.61 70.98 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.971 0.908 . . . . 0.0 111.475 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.76 -44.89 80.21 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.508 0.723 . . . . 0.0 110.476 171.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -71.57 -27.75 63.37 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.901 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 80.0 mt -66.67 111.98 3.95 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.384 0.611 . . . . 0.0 110.791 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -100.52 -22.07 15.12 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.285 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 41.2 p -127.96 149.22 50.43 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.377 0.671 . . . . 0.0 111.286 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.486 HG21 ' HB3' ' A' ' 50' ' ' SER . 45.0 t -66.0 -28.42 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.218 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 17.7 t70 -60.04 -41.46 92.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 122.761 0.424 . . . . 0.0 110.559 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.44 -29.9 69.49 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.23 0.612 . . . . 0.0 111.625 175.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 69.3 tp -64.74 -39.37 93.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.557 0.343 . . . . 0.0 110.623 171.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.72 -41.07 98.14 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.773 0.429 . . . . 0.0 110.522 174.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 73.6 mm-40 -62.45 -42.13 99.24 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.817 0.447 . . . . 0.0 110.509 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.582 HD13 ' HG2' ' A' ' 81' ' ' GLU . 42.3 tp -59.65 -61.01 2.94 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.057 0.943 . . . . 0.0 110.897 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 87.7 t -64.44 -40.75 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.151 0.581 . . . . 0.0 111.099 -172.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.02 -53.57 24.91 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.52 0.728 . . . . 0.0 110.246 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -66.51 -36.07 81.8 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.396 0.678 . . . . 0.0 111.707 -174.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 -84.7 -22.53 29.73 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.45 ' NH1' ' SD ' ' A' ' 27' ' ' MET . 46.5 ttt180 -74.62 -37.85 62.71 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.46 -51.88 52.1 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.791 0.837 . . . . 0.0 110.244 172.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 67.23 -69.77 0.13 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.464 1.906 . . . . 0.0 112.118 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 87.93 14.72 62.33 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 111.782 -0.527 . . . . 0.0 111.782 -174.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--O 1.249 1.039 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -176.338 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.9 mtm . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.28 146.67 11.68 Favored Glycine 0 C--N 1.345 1.083 0 N-CA-C 112.193 -0.363 . . . . 0.0 112.193 -177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 p -162.46 106.72 1.15 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.406 1.083 . . . . 0.0 108.985 176.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.9 m -120.6 26.17 9.31 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.029 0.932 . . . . 0.0 111.058 -178.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -70.93 101.09 2.08 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -154.52 151.78 29.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.364 1.066 . . . . 0.0 109.381 -174.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -126.46 149.37 49.35 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.969 0.908 . . . . 0.0 110.326 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -75.99 137.53 40.34 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.672 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -92.72 132.58 36.81 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -70.73 111.09 5.92 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.364 0.665 . . . . 0.0 111.139 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -79.99 142.83 34.65 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.865 0.866 . . . . 0.0 110.131 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.8 p -150.74 131.68 14.23 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.716 0.806 . . . . 0.0 110.222 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.35 73.74 0.25 Allowed Glycine 0 C--N 1.345 1.074 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 177.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -78.99 74.74 5.51 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.027 0.931 . . . . 0.0 109.099 -179.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -88.86 -25.55 22.1 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.128 -174.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -125.49 168.25 13.89 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.447 1.099 . . . . 0.0 110.608 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.33 89.51 6.09 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -66.02 106.26 1.55 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.428 -178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -156.04 141.05 17.31 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.079 0.552 . . . . 0.0 110.481 -175.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -151.44 170.2 20.17 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.749 1.22 . . . . 0.0 108.775 172.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.33 -59.34 2.57 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 177.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 56.46 -100.41 0.11 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 124.905 1.282 . . . . 0.0 110.497 -177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -147.57 163.17 28.99 Favored Pre-proline 0 N--CA 1.48 1.062 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.83 170.93 1.75 Allowed 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.918 1.745 . . . . 0.0 113.205 167.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.489 ' H ' ' HB3' ' A' ' 29' ' ' ASP . 0.7 OUTLIER 80.25 -98.57 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.437 1.895 . . . . 0.0 110.962 -177.595 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 51.99 -82.59 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 0.0 112.404 -172.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 11.5 tmm? -143.07 -51.57 0.36 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.927 0.891 . . . . 0.0 108.929 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.19 -61.83 2.1 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 124.054 0.846 . . . . 0.0 111.721 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 30.5 t70 -69.85 -24.69 63.48 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.881 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -65.77 -33.45 75.9 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.429 0.692 . . . . 0.0 110.477 170.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 91' ' ' LEU . 10.4 tt -68.8 -37.05 78.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.071 0.548 . . . . 0.0 110.079 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.566 HD23 ' HA ' ' A' ' 29' ' ' ASP . 2.6 mm? -62.77 -34.98 78.38 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 123.03 0.206 . . . . 0.0 111.144 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 37' ' ' VAL . 11.9 m -63.22 -42.22 99.24 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.457 0.703 . . . . 0.0 110.609 176.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.526 HG13 ' HG2' ' A' ' 68' ' ' LYS . 41.4 t -63.82 -43.07 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.38 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.02 -39.44 93.4 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.049 0.54 . . . . 0.0 111.484 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.5 p -68.15 -31.56 71.22 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.484 0.49 . . . . 0.0 111.682 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 33' ' ' THR . 87.8 t -75.04 -39.87 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.058 0 C-N-CA 122.876 0.47 . . . . 0.0 110.155 174.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.58 -29.94 62.71 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.649 0.78 . . . . 0.0 112.244 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.6 p -94.42 -53.78 3.78 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.192 0.597 . . . . 0.0 110.147 -178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.55 -15.04 9.89 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.951 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.8 m -92.67 145.72 30.9 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.363 0.665 . . . . 0.0 110.523 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -51.25 158.16 3.83 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.836 3.024 . . . . 0.0 115.162 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -63.35 -22.83 67.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.473 1.109 . . . . 0.0 111.984 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.42 -29.21 68.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.785 0.434 . . . . 0.0 111.147 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.62 0.56 56.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.601 0.761 . . . . 0.0 111.0 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.469 HG22 HD12 ' A' ' 32' ' ' LEU . 34.9 mt -129.82 105.96 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 123.674 0.789 . . . . 0.0 110.751 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.8 t -110.72 -177.77 3.31 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.737 0.815 . . . . 0.0 109.172 170.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.9 ptp85 -67.11 -33.36 75.3 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 173.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -70.43 -19.48 62.98 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.235 1.014 . . . . 0.0 111.3 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 m -66.44 149.23 50.73 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.873 0.844 . . . . 0.0 111.499 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.569 ' HD3' HG22 ' A' ' 87' ' ' THR . 16.4 mmt180 -82.98 -161.45 0.49 Allowed 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.183 178.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 49.5 mtt -130.99 -2.61 4.04 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.94 -10.92 23.98 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 118.833 0.742 . . . . 0.0 112.698 -173.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -141.88 26.57 1.88 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.746 0.818 . . . . 0.0 109.675 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 52' ' ' MET . 72.5 mt -136.35 -32.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.701 0.8 . . . . 0.0 112.616 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.51 -41.32 0.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 122.797 0.439 . . . . 0.0 112.0 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -61.28 87.78 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.925 1.29 . . . . 0.0 111.242 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 175.38 133.12 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.238 1.815 . . . . 0.0 106.307 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.3 m -52.29 -38.22 57.75 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 119.026 0.83 . . . . 0.0 113.17 -172.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.04 -41.23 62.12 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.472 0.709 . . . . 0.0 111.141 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.9 t -76.98 -24.84 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 122.317 0.247 . . . . 0.0 110.627 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.0 -39.95 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 171.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.2 t -62.92 -43.61 98.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.631 0.772 . . . . 0.0 111.009 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -72.53 -38.36 68.05 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.567 0.747 . . . . 0.0 111.376 -177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.14 -46.09 75.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.291 0.636 . . . . 0.0 109.795 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.7 t -63.37 -31.8 73.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.123 0.969 . . . . 0.0 111.258 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.4 tt -62.66 -46.57 87.61 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.526 ' HG2' HG13 ' A' ' 34' ' ' VAL . 0.1 OUTLIER -71.67 -35.88 70.45 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.461 -177.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -68.53 -42.55 78.33 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.847 0.459 . . . . 0.0 110.011 177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 76' ' ' THR . 2.0 tmt_? -64.56 -48.22 75.83 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.302 1.041 . . . . 0.0 110.221 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -82.31 -67.13 0.81 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.312 -175.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -77.77 -47.73 18.28 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.84 -164.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.464 ' CE1' HG21 ' A' ' 34' ' ' VAL . 80.2 m-85 -79.53 -24.43 42.2 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.047 0.539 . . . . 0.0 110.982 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.0 -5.22 83.64 Favored Glycine 0 C--N 1.349 1.287 0 O-C-N 123.279 0.362 . . . . 0.0 113.369 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.443 HG12 HG21 ' A' ' 78' ' ' VAL . 40.7 t -81.9 87.92 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.271 1.029 . . . . 0.0 108.681 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 45.8 p -71.16 134.63 47.1 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.963 -168.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 74.62 -110.24 3.02 Favored Glycine 0 C--N 1.348 1.227 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.291 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG11 HD21 ' A' ' 94' ' ' LEU . 10.2 t 69.46 8.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 125.571 1.549 . . . . 0.0 110.823 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -48.61 -41.78 32.01 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 125.387 1.475 . . . . 0.0 113.146 -168.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.52 -46.91 71.48 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.365 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -73.91 -25.0 59.77 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.69 0.396 . . . . 0.0 110.838 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.15 -32.62 70.67 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.978 0.911 . . . . 0.0 110.418 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -68.21 -36.29 79.32 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.072 171.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.91 -1.75 36.66 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.542 0.737 . . . . 0.0 112.589 177.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.495 HD11 HD13 ' A' ' 94' ' ' LEU . 65.7 mt -80.76 151.81 28.62 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.284 0.493 . . . . 0.0 111.599 176.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -132.45 -44.81 0.91 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 109.361 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.569 HG22 ' HD3' ' A' ' 51' ' ' ARG . 64.1 p -117.4 156.4 27.98 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.443 0.697 . . . . 0.0 110.852 -177.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 90.6 t -67.9 -33.16 59.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.15 174.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.22 -38.96 81.24 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.089 0.956 . . . . 0.0 110.589 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.07 -31.88 66.52 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.147 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 31' ' ' LEU . 44.1 tp -67.39 -33.9 76.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.124 0.57 . . . . 0.0 110.874 173.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -68.32 -38.96 82.08 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.93 0.492 . . . . 0.0 110.945 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -69.01 -29.18 67.31 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 175.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.495 HD13 HD11 ' A' ' 85' ' ' LEU . 9.6 tt -65.24 -59.52 3.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.648 0.779 . . . . 0.0 109.31 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 86.0 t -58.67 -30.88 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.004 0.922 . . . . 0.0 111.076 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.98 -52.84 63.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.12 0.968 . . . . 0.0 111.097 175.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -68.9 -30.05 68.45 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.533 0.733 . . . . 0.0 111.331 -177.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -83.14 -17.46 42.92 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.699 0.8 . . . . 0.0 111.612 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -83.22 -33.76 26.04 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.77 -35.59 72.68 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.718 0.807 . . . . 0.0 110.631 177.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -151.08 111.41 4.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.4 1.08 . . . . 0.0 108.126 175.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.27 23.56 3.28 Favored Glycine 0 N--CA 1.483 1.796 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 -174.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 6.8 p . . . . . 0 CA--C 1.554 1.114 0 C-N-CA 125.179 1.392 . . . . 0.0 108.067 178.583 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.73 54.13 0.01 OUTLIER Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.0 t -146.41 141.87 27.6 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.948 0.899 . . . . 0.0 109.782 -178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.7 p -80.37 105.84 11.93 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 176.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -81.67 164.86 21.51 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 110.153 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -62.13 -51.22 68.76 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.707 0.63 . . . . 0.0 111.944 -172.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -160.18 170.84 20.34 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 120.97 0.414 . . . . 0.0 111.216 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -127.01 140.69 52.12 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.525 1.13 . . . . 0.0 109.619 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -158.35 116.74 3.03 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.877 . . . . 0.0 109.091 175.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -95.25 124.93 39.54 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -91.02 59.41 4.04 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.656 0.741 . . . . 0.0 109.122 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.4 p -151.63 177.95 9.84 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.99 -174.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 85.8 -64.57 4.07 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 -178.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -87.1 -176.42 5.7 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.711 0.805 . . . . 0.0 110.039 174.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 62.97 24.02 14.33 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.484 1.114 . . . . 0.0 110.028 -178.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -93.24 10.09 33.38 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.414 1.085 . . . . 0.0 111.001 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mp -77.7 99.95 6.03 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.042 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -77.67 138.84 39.31 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.502 0.721 . . . . 0.0 110.412 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -74.54 -26.7 60.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.825 0.85 . . . . 0.0 110.96 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -97.27 26.89 4.48 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.057 0.943 . . . . 0.0 110.534 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -153.51 107.77 0.34 Allowed Glycine 0 C--N 1.343 0.953 0 N-CA-C 111.782 -0.527 . . . . 0.0 111.782 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -71.1 -47.54 57.53 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.238 0.519 . . . . 0.0 110.217 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 83.0 mtp -148.04 105.8 3.63 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 124.792 1.237 . . . . 0.0 108.397 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.74 144.57 49.15 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 122.061 1.841 . . . . 0.0 111.325 173.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -71.44 -19.96 62.16 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.371 0.668 . . . . 0.0 109.844 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.5 t70 74.83 148.8 0.1 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.608 1.563 . . . . 0.0 112.061 171.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 19.7 ttt -70.42 -54.83 10.8 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.425 176.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -61.67 -57.73 10.82 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.222 1.009 . . . . 0.0 112.784 -167.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -61.65 -43.09 99.51 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.558 0.536 . . . . 0.0 110.679 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -67.2 -32.0 72.77 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.048 0.842 . . . . 0.0 111.308 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 24.1 tp -64.83 -45.06 87.72 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.36 -31.24 72.26 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.202 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.3 m -67.66 -42.13 82.67 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.829 0.452 . . . . 0.0 109.939 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' HG3' ' A' ' 68' ' ' LYS . 22.3 t -60.84 -44.57 97.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.352 177.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 53.6 mt -67.94 -32.18 72.45 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.693 0.62 . . . . 0.0 110.908 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.3 t -64.84 -35.94 82.73 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.857 0.723 . . . . 0.0 111.072 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.2 t -82.92 -25.55 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.898 0.879 . . . . 0.0 110.68 178.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -82.91 -27.56 30.55 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.463 0.705 . . . . 0.0 111.904 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.1 p -107.07 -55.28 2.35 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.056 0.542 . . . . 0.0 110.544 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 130.86 -29.84 3.48 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.47 -178.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 m -79.03 140.9 57.91 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.685 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.515 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 37.7 Cg_endo -63.86 170.53 8.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.108 2.539 . . . . 0.0 113.323 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.21 -22.11 66.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.074 0.95 . . . . 0.0 111.705 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.68 -29.38 66.8 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.105 0.562 . . . . 0.0 110.835 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 11.4 mm-40 -92.5 6.33 47.52 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.346 0.658 . . . . 0.0 110.755 176.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -127.22 99.23 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.1 0.96 . . . . 0.0 108.821 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.495 ' OG ' ' HB2' ' A' ' 50' ' ' SER . 57.8 p -98.68 150.64 21.57 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -66.68 -24.29 66.25 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.9 0.88 . . . . 0.0 112.2 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -99.68 1.2 43.25 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.912 0.885 . . . . 0.0 111.18 -175.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.495 ' HB2' ' OG ' ' A' ' 47' ' ' SER . 9.0 t -83.35 170.21 14.81 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 123.438 0.695 . . . . 0.0 111.921 -176.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -67.68 147.65 52.38 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.149 165.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.652 ' HG3' ' HB2' ' A' ' 55' ' ' LEU . 19.8 ttt -102.29 -77.73 0.55 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.296 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 38.07 -80.07 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 113.896 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.12 -30.02 64.03 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.052 0.541 . . . . 0.0 112.218 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.652 ' HB2' ' HG3' ' A' ' 52' ' ' MET . 51.1 mt -70.75 -25.5 62.94 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.448 0.699 . . . . 0.0 112.345 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -170.35 96.6 0.25 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.067 0.947 . . . . 0.0 110.766 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -168.07 49.19 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 177.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.402 ' O ' HG23 ' A' ' 62' ' ' VAL . 10.5 t70 -161.94 134.81 6.02 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.986 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.6 p -47.71 -46.7 29.87 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.647 1.179 . . . . 0.0 113.377 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.3 tp -70.34 -39.81 74.47 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.588 0.355 . . . . 0.0 110.789 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 36.0 t -67.31 -34.86 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 123.254 0.347 . . . . 0.0 110.666 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.54 HG13 ' HB2' ' A' ' 82' ' ' LEU . 75.0 t -69.51 -39.06 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.914 0.885 . . . . 0.0 110.203 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.3 m -64.47 -44.58 90.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.402 0.681 . . . . 0.0 110.09 175.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -64.89 -44.84 88.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.28 1.032 . . . . 0.0 110.819 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.0 tp -69.21 -38.7 78.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.036 0.934 . . . . 0.0 110.407 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.0 t -61.13 -38.66 87.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.471 0.709 . . . . 0.0 110.68 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.497 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 94.0 mt -63.55 -48.75 76.21 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.875 0.735 . . . . 0.0 110.625 175.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.506 ' HG3' HG13 ' A' ' 34' ' ' VAL . 75.3 mmtt -59.72 -47.77 84.34 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.093 0.557 . . . . 0.0 111.196 -178.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.58 -29.78 69.22 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.516 0.727 . . . . 0.0 111.347 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.69 -53.06 37.63 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.197 0.999 . . . . 0.0 111.115 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 4.0 mptp? -72.4 -41.54 66.16 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.557 -177.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -82.2 -53.99 5.62 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.303 0.641 . . . . 0.0 112.175 -170.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -107.14 -14.77 14.83 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.157 0.583 . . . . 0.0 112.063 -171.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.28 -6.14 77.46 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 122.908 0.29 . . . . 0.0 112.885 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.577 HG12 HG21 ' A' ' 78' ' ' VAL . 46.0 t -80.93 80.12 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.082 0.953 . . . . 0.0 109.821 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 t -91.32 160.75 15.34 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.28 0.632 . . . . 0.0 111.251 -174.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.49 -110.97 3.15 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -178.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.577 HG21 HG12 ' A' ' 75' ' ' VAL . 3.4 t 58.15 26.19 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 125.231 1.412 . . . . 0.0 111.1 173.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -51.37 -57.67 8.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.25 1.42 . . . . 0.0 112.987 -166.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-20 -60.0 -43.49 95.17 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.071 0.857 . . . . 0.0 110.88 -176.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HB2' HG12 ' A' ' 78' ' ' VAL . 38.4 mt-10 -69.77 -40.95 75.77 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.036 0.535 . . . . 0.0 111.105 -173.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.54 ' HB2' HG13 ' A' ' 62' ' ' VAL . 76.6 mt -69.95 -25.16 63.51 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.948 0.499 . . . . 0.0 111.177 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.79 -16.51 31.93 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.181 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 0.3 OUTLIER -99.31 10.31 41.67 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.802 0.841 . . . . 0.0 110.052 -177.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.477 HD11 HD13 ' A' ' 91' ' ' LEU . 24.7 mt -69.29 115.46 8.58 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -173.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -91.23 -53.41 4.37 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.07 -178.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.5 p -127.04 158.41 37.03 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.795 0.838 . . . . 0.0 110.714 -177.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -66.06 -38.55 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -56.46 -34.23 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.328 1.051 . . . . 0.0 111.533 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.2 -40.62 86.49 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.264 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.477 HD13 HD11 ' A' ' 85' ' ' LEU . 63.4 tp -64.1 -34.46 78.08 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 123.673 0.608 . . . . 0.0 111.472 176.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -59.99 -52.53 65.01 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.798 0.439 . . . . 0.0 110.733 174.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -71.72 -19.29 62.07 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.792 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.545 HD21 HG11 ' A' ' 78' ' ' VAL . 8.2 tt -71.74 -57.69 4.14 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.706 0.802 . . . . 0.0 109.106 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.91 -31.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.325 0.65 . . . . 0.0 110.101 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -70.61 -37.71 73.87 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.631 0.773 . . . . 0.0 109.684 174.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.992 0.517 . . . . 0.0 109.822 177.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -72.9 -32.42 65.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.748 0.819 . . . . 0.0 111.25 176.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -66.09 -44.89 83.08 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.614 0.766 . . . . 0.0 110.096 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.58 64.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.286 1.034 . . . . 0.0 110.535 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.62 -17.83 61.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.481 0.712 . . . . 0.0 111.144 175.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 62.54 3.87 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.466 0.479 . . . . 0.0 112.45 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 CA--C 1.554 1.121 0 C-N-CA 124.1 0.96 . . . . 0.0 109.101 -178.774 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -170.69 151.57 16.48 Favored Glycine 0 C--N 1.34 0.752 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.3 p -137.66 160.52 38.97 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.419 0.688 . . . . 0.0 110.688 -178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -111.89 80.85 1.37 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.803 0.841 . . . . 0.0 109.469 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -99.7 -52.03 3.57 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 68.13 144.57 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.348 1.459 . . . . 0.0 113.047 173.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -113.35 8.81 18.11 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.045 171.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.5 t60 -73.65 97.95 2.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.303 1.041 . . . . 0.0 110.176 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -158.04 116.53 3.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.413 0.685 . . . . 0.0 110.365 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -98.23 147.6 24.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.028 0.931 . . . . 0.0 109.505 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.0 t -135.2 166.89 22.05 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.411 0.684 . . . . 0.0 109.816 173.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.7 t -152.93 172.82 16.22 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.257 1.023 . . . . 0.0 108.693 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 175.49 126.53 0.95 Allowed Glycine 0 C--N 1.339 0.702 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -119.17 154.11 33.83 Favored 'General case' 0 C--O 1.247 0.926 0 C-N-CA 123.489 0.716 . . . . 0.0 110.475 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -69.73 114.95 8.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.531 172.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -94.09 127.54 39.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.644 0.378 . . . . 0.0 110.009 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 98.2 mt -119.67 104.54 10.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.574 0.749 . . . . 0.0 109.074 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -120.42 137.02 54.55 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.238 1.015 . . . . 0.0 109.204 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -68.65 110.72 4.39 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 123.596 0.758 . . . . 0.0 110.14 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -88.03 98.68 11.66 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.573 0.749 . . . . 0.0 109.389 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.29 107.07 2.87 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.354 -0.385 . . . . 0.0 112.325 178.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -164.51 100.57 0.81 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.442 1.097 . . . . 0.0 108.232 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tpt -76.01 111.5 15.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.706 0.803 . . . . 0.0 109.504 177.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -86.66 83.74 1.11 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 122.831 2.354 . . . . 0.0 111.651 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -137.39 83.22 1.98 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.695 0.798 . . . . 0.0 109.426 -175.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -164.38 150.21 10.59 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.032 0.533 . . . . 0.0 109.993 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ttt -57.29 -52.56 64.83 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.866 0.867 . . . . 0.0 111.174 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.427 ' HG2' ' CE1' ' A' ' 92' ' ' PHE . 9.2 tm-20 -62.37 -39.92 94.76 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.879 0.872 . . . . 0.0 109.857 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -59.16 -50.78 72.73 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.225 0.61 . . . . 0.0 111.119 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 34' ' ' VAL . 34.8 m-70 -64.74 -36.47 84.4 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.267 0.627 . . . . 0.0 110.886 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.48 -37.41 74.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.1 tp -71.76 -28.66 63.79 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.997 0.919 . . . . 0.0 110.187 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.6 m -71.98 -42.65 66.26 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.278 1.031 . . . . 0.0 109.952 174.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 30' ' ' HIS . 37.1 t -55.3 -46.14 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 123.567 0.747 . . . . 0.0 109.966 174.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.403 HD21 HD23 ' A' ' 91' ' ' LEU . 94.7 mt -62.14 -43.49 98.71 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.042 176.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.4 t -65.07 -34.83 79.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.033 0.933 . . . . 0.0 111.892 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.02 -37.45 17.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.481 0.712 . . . . 0.0 109.984 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.85 -26.83 59.97 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.649 0.78 . . . . 0.0 111.861 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.401 ' OG ' HG22 ' A' ' 41' ' ' VAL . 83.8 p -96.46 -41.57 8.52 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.625 0.77 . . . . 0.0 110.68 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.65 -15.11 62.42 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.374 -173.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.401 HG22 ' OG ' ' A' ' 39' ' ' SER . 16.0 m -86.76 147.05 42.56 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 123.16 0.584 . . . . 0.0 110.342 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -52.78 155.52 10.59 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.128 2.552 . . . . 0.0 113.956 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -63.57 -26.17 68.57 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.292 0.637 . . . . 0.0 111.139 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.01 -31.14 71.49 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.794 0.838 . . . . 0.0 111.413 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.57 -30.44 64.4 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.511 0.724 . . . . 0.0 110.537 176.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.2 mt -89.67 97.12 6.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.889 -174.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -79.58 156.92 27.48 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 167.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' O ' HG23 ' A' ' 88' ' ' VAL . 3.0 mpt_? -68.49 -30.28 69.07 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.22 87.04 6.35 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.2 t -142.83 142.57 31.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.708 0.803 . . . . 0.0 108.898 172.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -85.86 18.24 3.05 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.011 0.924 . . . . 0.0 112.013 -176.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 49.1 mtt 60.72 24.45 14.29 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 124.287 1.035 . . . . 0.0 112.188 176.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -32.92 -58.61 0.36 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 126.286 1.834 . . . . 0.0 113.497 -169.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.72 9.75 4.64 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.389 -0.823 . . . . 0.0 108.901 172.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.03 -42.4 17.53 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.701 0.8 . . . . 0.0 112.028 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -150.5 -1.94 0.38 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -86.31 76.56 9.66 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -179.8 136.3 0.12 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.275 1.43 . . . . 0.0 108.32 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.2 p -58.23 -36.84 73.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.134 0.974 . . . . 0.0 113.144 -173.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.39 -38.37 74.68 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.9 t -71.58 -31.13 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.413 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 66.7 t -69.33 -34.58 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.693 0.797 . . . . 0.0 110.168 174.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.6 t -73.76 -33.72 64.4 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.192 0.597 . . . . 0.0 110.585 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.7 -39.91 84.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.354 0.661 . . . . 0.0 109.538 173.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD11 HD21 ' A' ' 91' ' ' LEU . 59.3 tp -63.22 -51.87 64.5 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.62 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 62.0 p -62.63 -36.32 82.43 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.874 0.87 . . . . 0.0 111.376 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 42.9 tp -64.95 -41.72 95.25 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.741 0.65 . . . . 0.0 110.854 175.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -69.09 -35.94 77.04 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.289 0.635 . . . . 0.0 111.271 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 88.2 mt -67.75 -32.9 73.82 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.911 0.485 . . . . 0.0 110.038 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -30.88 71.9 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.768 1.227 . . . . 0.0 111.289 175.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -93.59 -61.77 1.49 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.089 0.555 . . . . 0.0 111.335 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -61.6 -47.76 84.0 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.701 1.2 . . . . 0.0 112.063 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -108.64 -18.88 13.61 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 -172.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 85.2 -13.41 54.92 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-O 120.095 -0.281 . . . . 0.0 113.25 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.61 100.57 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.764 0.826 . . . . 0.0 109.206 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 39.7 m -90.78 141.38 28.87 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.836 0.854 . . . . 0.0 111.794 -169.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.39 -107.72 2.68 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.819 174.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 81' ' ' GLU . 3.7 t 64.55 15.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.94 1.296 . . . . 0.0 110.883 177.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.64 -28.39 67.19 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.578 1.151 . . . . 0.0 113.457 -166.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -63.27 -51.36 66.47 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 123.68 0.613 . . . . 0.0 110.281 175.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HB2' HG12 ' A' ' 78' ' ' VAL . 4.4 mp0 -68.9 -31.94 71.22 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.154 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.1 mt -73.17 -18.03 61.31 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -78.34 -35.86 47.02 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.434 0.694 . . . . 0.0 109.596 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.79 2.1 10.95 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.561 0.744 . . . . 0.0 112.499 176.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.625 HD11 HD13 ' A' ' 91' ' ' LEU . 38.8 mt -70.05 140.72 52.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.024 0.529 . . . . 0.0 112.007 172.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -135.41 -51.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.416 0 O-C-N 124.509 1.131 . . . . 0.0 108.206 170.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.7 p -102.87 149.07 24.87 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.129 0.572 . . . . 0.0 110.679 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 48' ' ' ARG . 4.0 m -67.38 -26.73 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.615 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.52 -45.55 77.11 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.817 . . . . 0.0 110.528 169.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.86 -40.8 85.4 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-N 114.854 -1.067 . . . . 0.0 109.877 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.625 HD13 HD11 ' A' ' 85' ' ' LEU . 47.0 tp -65.87 -39.26 90.53 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.659 0.783 . . . . 0.0 112.425 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CE1' ' HG2' ' A' ' 28' ' ' GLU . 60.4 m-85 -62.06 -36.99 83.32 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.585 ' HA ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -82.95 -23.13 33.57 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.706 0.802 . . . . 0.0 112.271 178.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 tt -74.45 -55.37 6.04 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.1 t -60.55 -37.28 74.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.032 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.52 -45.75 84.63 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 123.948 0.78 . . . . 0.0 111.233 173.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -57.85 -48.47 79.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.922 0.889 . . . . 0.0 111.072 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -82.25 -33.83 29.07 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.621 -174.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.08 -42.07 48.49 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.57 -54.07 49.91 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.166 0.587 . . . . 0.0 110.28 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 65.64 156.38 0.09 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.773 1.229 . . . . 0.0 113.304 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.56 -25.63 11.87 Favored Glycine 0 N--CA 1.471 1.012 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.6 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 55.4 m . . . . . 0 CA--C 1.548 0.901 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 174.102 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.801 0.334 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.25 105.82 0.24 Allowed Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 m -82.86 115.17 21.62 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.724 0.81 . . . . 0.0 110.2 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.2 m -70.16 89.51 0.64 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.419 0.687 . . . . 0.0 109.787 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -86.56 118.1 25.76 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.28 149.85 24.77 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.091 0.956 . . . . 0.0 110.965 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -141.05 73.77 1.43 Allowed 'General case' 0 C--N 1.351 0.646 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -79.89 169.13 18.34 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.688 166.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -133.75 138.93 46.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.086 0.954 . . . . 0.0 109.047 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -74.05 126.48 30.6 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.25 0.62 . . . . 0.0 110.308 -178.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.9 p -72.34 88.7 1.19 Allowed 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 171.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.9 t -111.94 10.87 20.61 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.515 1.126 . . . . 0.0 110.851 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.19 82.54 0.65 Allowed Glycine 0 C--N 1.347 1.176 0 O-C-N 123.162 0.289 . . . . 0.0 112.965 -175.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.4 -83.5 0.22 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 175.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 54.47 -159.52 0.17 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.343 1.057 . . . . 0.0 111.848 174.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 51.69 85.19 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.053 1.341 . . . . 0.0 112.574 172.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.69 108.89 3.09 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.072 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 28.3 p90 -71.15 121.65 18.7 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.676 1.19 . . . . 0.0 111.354 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -133.96 98.77 4.24 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.034 0.933 . . . . 0.0 108.879 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 55.34 71.51 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.434 1.094 . . . . 0.0 110.981 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.71 -84.83 0.06 OUTLIER Glycine 0 C--N 1.353 1.497 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.972 -174.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.1 t60 52.86 79.09 0.12 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.725 1.21 . . . . 0.0 110.608 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.2 ptp -125.08 97.85 37.12 Favored Pre-proline 0 N--CA 1.479 1.019 0 CA-C-O 121.133 0.492 . . . . 0.0 111.128 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.25 176.54 8.66 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.492 2.128 . . . . 0.0 110.942 168.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -77.38 -57.54 3.77 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.7 t70 65.87 164.95 0.18 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.878 1.271 . . . . 0.0 111.666 173.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 ttp -122.33 -44.1 2.27 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.461 -0.775 . . . . 0.0 111.01 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.99 -61.93 1.68 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.899 0.88 . . . . 0.0 112.069 -171.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -65.2 -30.92 71.86 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.704 0.802 . . . . 0.0 110.478 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -63.17 -41.1 99.17 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.741 0.817 . . . . 0.0 109.584 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.506 HD21 ' HG ' ' A' ' 91' ' ' LEU . 39.2 tp -66.69 -38.92 87.75 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.184 0.994 . . . . 0.0 110.003 177.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.5 tp -62.23 -38.74 90.38 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.489 1.116 . . . . 0.0 110.777 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.3 m -66.56 -42.37 87.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.114 0.966 . . . . 0.0 110.684 176.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 t -57.87 -45.88 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.697 0.799 . . . . 0.0 110.861 177.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 83.5 mt -63.04 -37.94 89.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.519 0.728 . . . . 0.0 111.133 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -61.89 -37.98 86.63 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.509 0.724 . . . . 0.0 111.242 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 56.7 t -79.72 -32.91 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.506 0.723 . . . . 0.0 110.539 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.19 -14.07 58.74 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.757 0.823 . . . . 0.0 111.914 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.463 ' OG ' ' HA ' ' A' ' 55' ' ' LEU . 18.4 m -112.24 -38.86 4.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.256 0.622 . . . . 0.0 110.847 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.7 -30.28 10.58 Favored Glycine 0 C--N 1.341 0.808 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.008 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.62 137.84 88.33 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.289 0.635 . . . . 0.0 110.364 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.71 161.44 10.06 Favored 'Trans proline' 0 C--N 1.379 2.138 0 C-N-CA 123.46 2.773 . . . . 0.0 113.802 178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.92 -29.42 70.77 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.713 0.805 . . . . 0.0 111.214 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.53 -18.22 64.32 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 111.609 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -89.49 -20.08 24.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.415 0.686 . . . . 0.0 111.175 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.4 mt -102.43 105.04 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.975 0.51 . . . . 0.0 110.892 -174.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 79.9 p -95.27 -178.02 4.31 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 165.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.73 ' HA ' ' HB ' ' A' ' 88' ' ' VAL . 11.0 ptp180 -84.73 -11.53 55.64 Favored 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.596 -0.69 . . . . 0.0 111.25 175.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.99 13.45 28.91 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.607 0.763 . . . . 0.0 110.456 172.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -85.02 18.34 2.54 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.259 0.624 . . . . 0.0 112.577 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.4 ' O ' HD12 ' A' ' 55' ' ' LEU . 3.8 mmm180 68.12 167.01 0.25 Allowed 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.145 175.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.507 ' HG3' ' HB3' ' A' ' 85' ' ' LEU . 87.9 mmm -121.53 94.47 4.33 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 170.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -137.92 -65.66 0.51 Allowed 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -83.43 -35.14 25.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.245 176.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 70.1 mt -69.69 -44.11 71.1 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.257 -172.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.92 94.95 0.08 Allowed 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.512 1.133 . . . . 0.0 109.68 169.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -163.64 -37.66 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.088 0.955 . . . . 0.0 108.496 175.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -53.98 139.53 34.05 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.046 0.841 . . . . 0.0 110.041 168.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -47.73 -47.29 30.24 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.103 1.361 . . . . 0.0 113.183 -173.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.3 mt -80.36 -25.83 38.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.872 -174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.1 t -77.29 -29.24 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 123.174 0.296 . . . . 0.0 110.207 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.4 t -70.14 -44.68 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.619 0.768 . . . . 0.0 109.897 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.8 p -67.76 -33.58 75.13 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.548 0.53 . . . . 0.0 110.777 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.63 -47.65 74.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.758 0.823 . . . . 0.0 110.422 175.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.8 tp -68.89 -40.48 79.18 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 -174.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 66.5 m -62.6 -48.38 79.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.978 0.511 . . . . 0.0 110.949 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.3 tp -57.05 -36.23 70.26 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.865 0.728 . . . . 0.0 110.483 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.0 tppt? -68.61 -52.93 26.11 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.368 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HB3' ' HB ' ' A' ' 75' ' ' VAL . 83.6 mt -52.01 -44.11 63.99 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.11 0.964 . . . . 0.0 111.532 -175.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -61.06 -36.93 80.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.472 1.109 . . . . 0.0 111.92 -174.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -97.92 -64.87 1.0 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.964 0.506 . . . . 0.0 110.905 178.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.86 -40.62 63.58 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.704 1.602 . . . . 0.0 113.24 -173.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -120.57 -14.79 8.59 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -171.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 73.85 16.42 79.34 Favored Glycine 0 CA--C 1.534 1.249 0 N-CA-C 113.862 0.305 . . . . 0.0 113.862 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.612 HG21 HG13 ' A' ' 95' ' ' VAL . 59.1 t -93.87 136.16 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 123.86 0.864 . . . . 0.0 108.854 176.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -67.37 156.99 35.13 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 122.736 0.415 . . . . 0.0 111.4 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.16 88.28 0.15 Allowed Glycine 0 C--N 1.357 1.699 0 O-C-N 123.41 0.444 . . . . 0.0 112.994 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.6 m -94.14 47.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.312 1.045 . . . . 0.0 111.226 -174.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -48.12 -39.85 21.76 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.409 1.484 . . . . 0.0 113.963 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.99 -52.45 65.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.335 1.054 . . . . 0.0 110.085 -179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.11 -25.71 61.85 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -176.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.23 -31.09 70.34 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.856 0.463 . . . . 0.0 110.85 174.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.53 -26.45 45.75 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.776 174.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -90.21 12.97 16.42 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.908 0.483 . . . . 0.0 112.22 176.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.528 HD21 HD22 ' A' ' 94' ' ' LEU . 94.1 mt -80.09 148.42 31.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.665 0.386 . . . . 0.0 110.63 172.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -115.47 -55.88 2.4 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.587 0.755 . . . . 0.0 109.858 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 71.3 p -119.44 163.61 16.99 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.896 0.879 . . . . 0.0 109.637 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 48' ' ' ARG . 11.0 t -69.63 -23.25 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 30.6 t70 -57.12 -48.45 78.62 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.372 0.669 . . . . 0.0 109.739 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -55.75 -39.21 70.85 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.085 0.866 . . . . 0.0 111.265 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.506 ' HG ' HD21 ' A' ' 31' ' ' LEU . 44.4 tp -63.42 -48.45 77.74 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 123.707 0.63 . . . . 0.0 111.601 176.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -60.46 -34.75 74.46 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.363 0.665 . . . . 0.0 110.932 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 16.7 mm100 -75.91 -36.68 59.34 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.608 0.567 . . . . 0.0 110.501 177.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD22 HD21 ' A' ' 85' ' ' LEU . 26.7 tp -61.2 -53.47 56.46 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.448 0.699 . . . . 0.0 109.748 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.612 HG13 HG21 ' A' ' 75' ' ' VAL . 84.7 t -61.8 -34.73 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.659 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.43 -62.53 1.78 Allowed 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.607 0.763 . . . . 0.0 111.476 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -38.66 90.42 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.881 0.473 . . . . 0.0 111.66 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -74.44 -25.27 59.32 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.308 0.643 . . . . 0.0 112.713 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -88.28 -35.25 17.35 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.549 0.34 . . . . 0.0 110.319 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.93 -31.17 66.08 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.447 0.699 . . . . 0.0 110.77 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 55.61 34.81 23.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.885 1.274 . . . . 0.0 111.7 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -63.69 -18.29 61.43 Favored Glycine 0 C--N 1.355 1.613 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.966 -175.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.248 0.999 0 C-N-CA 124.066 0.946 . . . . 0.0 108.75 175.679 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.69 47.47 0.02 OUTLIER Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.831 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.8 p -72.77 117.3 14.31 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 122.937 0.495 . . . . 0.0 110.013 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.7 m -139.76 128.47 23.18 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.679 0.792 . . . . 0.0 109.379 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -143.85 121.86 12.09 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -126.7 163.95 22.38 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.285 0.634 . . . . 0.0 109.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -130.91 26.14 4.96 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.159 0.983 . . . . 0.0 110.362 -173.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -74.19 80.12 1.79 Allowed 'General case' 0 CA--C 1.556 1.194 0 CA-C-O 122.114 0.959 . . . . 0.0 111.376 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -156.19 -34.3 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.22 1.408 . . . . 0.0 108.759 176.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -103.17 113.73 27.44 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -139.06 33.48 2.14 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.805 0.842 . . . . 0.0 109.074 -179.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.2 m -60.91 118.63 6.93 Favored 'General case' 0 C--N 1.354 0.773 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.119 -176.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -165.75 167.34 39.05 Favored Glycine 0 C--N 1.336 0.543 0 O-C-N 123.771 0.669 . . . . 0.0 111.916 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.4 ttm105 -86.66 125.07 33.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.933 0.893 . . . . 0.0 110.787 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.45 133.09 35.2 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 164.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -79.36 75.92 5.94 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.284 0.564 . . . . 0.0 110.753 -172.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -96.02 103.03 14.9 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.903 0.881 . . . . 0.0 108.696 174.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -80.81 -70.64 0.51 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 63.84 141.4 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.452 1.501 . . . . 0.0 111.964 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.1 tm0? -139.64 116.63 11.02 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 162.35 176.97 34.98 Favored Glycine 0 C--N 1.342 0.893 0 O-C-N 123.857 0.723 . . . . 0.0 112.008 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -124.24 -18.5 5.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.699 0.8 . . . . 0.0 111.069 -178.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 69.47 169.77 0.11 Allowed Pre-proline 0 N--CA 1.493 1.682 0 C-N-CA 124.354 1.062 . . . . 0.0 108.902 -160.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 25' ' ' ASN . 36.1 Cg_exo -59.37 -91.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 121.713 1.609 . . . . 0.0 112.861 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.409 ' H ' ' HB2' ' A' ' 24' ' ' PRO . 4.4 p-10 177.09 24.53 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.611 1.164 . . . . 0.0 108.807 -176.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -80.07 -61.49 1.97 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.756 1.222 . . . . 0.0 112.156 -167.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.532 ' SD ' HD13 ' A' ' 31' ' ' LEU . 19.4 tmm? -172.54 -39.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.11 0.964 . . . . 0.0 108.839 -167.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -59.1 -49.83 76.39 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.066 0.546 . . . . 0.0 110.831 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -49.72 -40.53 40.95 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.345 1.058 . . . . 0.0 111.536 171.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.12 -38.47 69.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.613 0.765 . . . . 0.0 111.287 -173.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.532 HD13 ' SD ' ' A' ' 27' ' ' MET . 11.1 mp -69.75 -33.29 72.23 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 117.973 0.351 . . . . 0.0 110.758 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.34 -33.9 77.06 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.428 0.455 . . . . 0.0 110.41 172.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.9 m -71.88 -39.82 69.36 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.214 0.605 . . . . 0.0 110.337 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.0 t -58.51 -49.63 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.797 0.839 . . . . 0.0 110.042 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.25 -28.3 66.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.628 0.771 . . . . 0.0 111.556 177.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 41' ' ' VAL . 29.9 t -66.1 -38.17 87.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.842 0.457 . . . . 0.0 111.015 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.2 t -87.17 -30.12 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.09 47.82 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.233 0.613 . . . . 0.0 112.032 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.2 m -108.62 -26.0 10.6 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.184 0.594 . . . . 0.0 111.495 -175.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.49 -27.48 19.35 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-O 119.997 -0.335 . . . . 0.0 112.83 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' SER . 36.0 m -73.0 141.11 81.21 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 123.16 0.584 . . . . 0.0 110.214 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.42 165.63 29.92 Favored 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 122.354 2.036 . . . . 0.0 112.163 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -60.86 -23.31 65.05 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.907 0.883 . . . . 0.0 111.999 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.41 -29.18 65.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.197 0.999 . . . . 0.0 110.887 -176.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -79.66 -11.08 59.87 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.732 0.813 . . . . 0.0 111.343 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.0 mt -110.24 146.78 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.852 0.861 . . . . 0.0 109.743 -174.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.8 p -145.27 157.21 44.11 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 171.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -66.08 -22.51 66.41 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 117.759 0.254 . . . . 0.0 111.145 -176.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -112.07 92.63 4.1 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 171.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -159.34 160.99 35.69 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.317 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.432 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmm180 -84.66 129.65 34.81 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.875 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.418 ' HE3' ' HA ' ' A' ' 88' ' ' VAL . 28.0 mtt -88.58 56.12 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.069 0.948 . . . . 0.0 110.116 174.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.432 ' HG2' ' HB3' ' A' ' 51' ' ' ARG . 21.4 mm-40 -71.13 -16.85 62.58 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.827 175.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.92 -30.27 0.53 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.267 1.027 . . . . 0.0 110.737 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.0 mp -73.79 -10.05 59.27 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -160.95 33.03 0.15 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.793 0.837 . . . . 0.0 109.311 172.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -99.15 -62.1 1.28 Allowed 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.053 -171.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.501 ' HB3' HG23 ' A' ' 61' ' ' VAL . 34.5 t70 -66.8 152.62 45.19 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.991 0.516 . . . . 0.0 111.704 -176.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 m -52.8 -42.71 65.34 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.107 1.363 . . . . 0.0 112.656 -178.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -67.03 -42.23 85.23 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.834 0.709 . . . . 0.0 110.493 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.501 HG23 ' HB3' ' A' ' 58' ' ' ASP . 21.7 t -64.46 -41.86 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 O-C-N 123.693 0.621 . . . . 0.0 110.482 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.8 t -66.53 -38.95 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.977 0.911 . . . . 0.0 110.503 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.6 t -66.81 -42.38 86.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.726 0.81 . . . . 0.0 110.938 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 41.0 mt-10 -74.48 -33.06 62.76 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.836 0.854 . . . . 0.0 110.588 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.7 tp -65.19 -41.16 94.82 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.018 0.927 . . . . 0.0 109.734 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.8 t -62.73 -46.42 88.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.118 0.967 . . . . 0.0 110.88 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.79 -30.69 70.95 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.068 -176.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 44.8 mmtm -71.11 -59.71 2.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.783 0.433 . . . . 0.0 110.776 175.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 91' ' ' LEU . 95.9 mt -60.71 -27.6 68.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.526 0.73 . . . . 0.0 112.242 -174.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -53.14 -56.13 18.74 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.657 1.183 . . . . 0.0 109.683 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -81.47 -40.56 23.09 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.098 -176.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -73.29 -45.87 53.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.938 0.895 . . . . 0.0 112.152 -166.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.26 -8.74 7.01 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.025 -176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.53 3.64 90.1 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 120.167 -0.24 . . . . 0.0 113.022 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.547 HG12 HG21 ' A' ' 78' ' ' VAL . 59.2 t -81.89 83.8 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.928 0.891 . . . . 0.0 109.239 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.8 t -130.53 159.41 37.19 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.766 1.226 . . . . 0.0 109.009 178.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 78.51 24.73 62.33 Favored Glycine 0 C--N 1.337 0.638 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -167.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.547 HG21 HG12 ' A' ' 75' ' ' VAL . 28.0 m -122.4 17.47 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.299 1.44 . . . . 0.0 109.903 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' A' ' 82' ' ' LEU . 25.6 t70 -63.96 -31.76 73.06 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.704 0.802 . . . . 0.0 112.063 -170.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -60.91 -48.78 80.24 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.023 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.402 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.1 mt-10 -63.57 -37.18 86.34 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.495 0.718 . . . . 0.0 111.429 178.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 79' ' ' ASP . 92.1 mt -62.4 -38.11 88.4 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.002 0.921 . . . . 0.0 111.392 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -74.28 -24.5 59.27 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.451 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.4 mt -89.23 -2.79 58.63 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.699 0.799 . . . . 0.0 111.945 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 70.9 mt -77.74 115.33 17.41 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.041 0.448 . . . . 0.0 110.403 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -116.45 -1.71 12.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.369 1.068 . . . . 0.0 109.945 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 p -143.24 137.81 29.18 Favored 'General case' 0 C--O 1.257 1.484 0 C-N-CA 124.732 1.213 . . . . 0.0 109.608 -176.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.418 ' HA ' ' HE3' ' A' ' 52' ' ' MET . 53.4 t -64.86 -35.38 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 -176.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 93' ' ' GLN . 34.0 t70 -61.93 -35.25 77.86 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.78 0.432 . . . . 0.0 111.001 179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -68.48 -28.11 66.74 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.811 0.444 . . . . 0.0 111.713 176.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.502 HD11 HD11 ' A' ' 69' ' ' LEU . 65.7 tp -61.99 -41.0 97.54 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 123.196 0.31 . . . . 0.0 110.616 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.407 ' HD1' ' O ' ' A' ' 88' ' ' VAL . 25.7 m-85 -66.29 -39.47 89.38 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.42 0.688 . . . . 0.0 111.751 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 61.7 mm-40 -69.55 -35.43 75.4 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 78' ' ' VAL . 43.2 tp -58.33 -55.43 35.07 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.011 0.924 . . . . 0.0 110.456 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.38 -46.46 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.785 -177.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.17 -54.63 43.61 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.658 0.783 . . . . 0.0 112.032 -176.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.23 -43.16 82.67 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.393 0.677 . . . . 0.0 111.506 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -75.83 -18.23 59.54 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.349 0.406 . . . . 0.0 112.057 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -86.34 -28.56 23.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.53 -43.7 63.17 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.352 0.661 . . . . 0.0 110.565 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 56.44 42.63 27.25 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.769 1.228 . . . . 0.0 111.47 178.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -63.68 -36.75 93.74 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.056 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 C--O 1.25 1.092 0 C-N-CA 123.879 0.872 . . . . 0.0 109.458 175.355 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.97 49.69 Favored Glycine 0 C--N 1.34 0.776 0 O-C-N 123.682 0.614 . . . . 0.0 113.319 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 p -172.34 170.61 4.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.678 1.191 . . . . 0.0 109.938 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.6 m -72.38 -57.15 4.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.5 t60 56.01 75.59 0.33 Allowed 'General case' 0 C--N 1.36 1.047 0 C-N-CA 124.974 1.309 . . . . 0.0 109.808 -174.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -87.57 146.32 25.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.596 -176.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -72.53 -51.01 21.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.047 0.539 . . . . 0.0 111.298 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -155.03 134.05 12.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.931 0.492 . . . . 0.0 110.488 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -81.68 148.14 29.16 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -73.15 148.32 43.98 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.444 0.298 . . . . 0.0 110.398 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -66.52 -50.23 63.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.187 0.595 . . . . 0.0 110.001 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.1 m -152.47 -67.32 0.16 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.282 1.033 . . . . 0.0 109.845 174.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 74.32 60.57 3.48 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 123.307 0.379 . . . . 0.0 112.356 -175.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -75.36 -37.09 60.83 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.797 0.839 . . . . 0.0 110.947 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -70.48 136.46 49.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.8 0.44 . . . . 0.0 110.126 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -71.25 96.97 1.48 Allowed 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.981 0.912 . . . . 0.0 108.897 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.4 mp 63.41 -153.93 0.33 Allowed 'General case' 0 CA--C 1.557 1.24 0 O-C-N 124.217 0.948 . . . . 0.0 109.215 -172.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -155.0 -59.21 0.11 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 171.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -79.72 106.58 11.85 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.182 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -165.97 110.11 0.81 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 155.22 -34.79 0.66 Allowed Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.657 -0.577 . . . . 0.0 111.657 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -86.63 66.7 9.6 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.805 0.812 . . . . 0.0 108.838 177.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -169.24 121.61 0.65 Allowed Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.289 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.24 98.33 0.38 Allowed 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.683 2.255 . . . . 0.0 110.876 172.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -65.02 114.82 4.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.829 0.852 . . . . 0.0 110.901 -177.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -70.45 91.98 0.79 Allowed 'General case' 0 C--O 1.242 0.693 0 C-N-CA 124.014 0.926 . . . . 0.0 111.115 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.3 ptm -64.12 -22.56 66.98 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.957 173.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.83 -50.33 67.08 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 124.259 1.023 . . . . 0.0 110.826 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -69.17 -31.99 71.01 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 123.683 0.614 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -65.73 -42.52 90.91 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.692 176.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.4 tt -70.68 -32.68 70.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.86 1.264 . . . . 0.0 109.173 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.7 tp -67.75 -36.72 81.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.162 0.985 . . . . 0.0 109.909 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.1 m -69.99 -36.29 75.05 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.15 0.98 . . . . 0.0 110.766 176.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.53 -46.78 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.384 0.674 . . . . 0.0 110.059 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.407 HD21 HD21 ' A' ' 91' ' ' LEU . 98.4 mt -68.33 -28.56 67.26 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.109 0.964 . . . . 0.0 111.606 177.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -65.4 -53.71 39.23 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.202 0.601 . . . . 0.0 110.249 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.85 -37.03 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.784 -178.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.83 -50.53 66.31 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.107 0.563 . . . . 0.0 111.33 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m -79.68 -21.0 45.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.277 0.631 . . . . 0.0 111.142 -178.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.35 4.77 83.29 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-O 119.769 -0.462 . . . . 0.0 113.6 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.8 m -105.86 149.39 37.95 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.357 1.063 . . . . 0.0 109.969 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.523 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 29.7 Cg_endo -61.75 160.16 30.01 Favored 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 122.176 1.917 . . . . 0.0 112.389 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.18 -20.88 65.81 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.582 0.753 . . . . 0.0 111.649 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -68.86 -20.2 64.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.025 0.93 . . . . 0.0 112.109 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.523 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 18.0 mm-40 -82.24 -29.11 31.48 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.21 0.604 . . . . 0.0 110.527 174.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 HD23 ' A' ' 55' ' ' LEU . 6.2 mt -88.71 90.83 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.54 -172.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.3 t -79.22 -0.64 32.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.562 0.745 . . . . 0.0 111.794 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 mtm180 75.15 -35.78 0.29 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 126.465 1.906 . . . . 0.0 112.067 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -76.97 3.1 12.97 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.25 1.02 . . . . 0.0 111.327 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.7 t -54.17 132.67 43.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.399 1.079 . . . . 0.0 110.825 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -91.99 31.35 1.26 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.773 0.829 . . . . 0.0 111.446 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.753 ' HB3' ' HB2' ' A' ' 57' ' ' PHE . 17.0 mmt 62.86 15.94 8.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.147 0.979 . . . . 0.0 112.694 174.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.66 -46.16 89.86 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.475 0.71 . . . . 0.0 112.32 -168.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -124.9 5.45 8.03 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.936 0.894 . . . . 0.0 109.972 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.426 HD23 HG12 ' A' ' 46' ' ' ILE . 3.5 mp -123.65 122.02 37.05 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.277 0.631 . . . . 0.0 110.235 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.612 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . 74.2 -28.93 0.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.753 ' HB2' ' HB3' ' A' ' 52' ' ' MET . 50.4 t80 -82.56 -19.45 38.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.539 0.736 . . . . 0.0 112.731 -169.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.86 136.18 57.93 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.703 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.9 m -54.36 -39.66 67.37 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.654 0.782 . . . . 0.0 113.084 -170.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.3 -42.27 93.23 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.39 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 27.2 t -74.99 -23.28 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.402 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.2 t -71.58 -34.03 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 172.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.1 m -69.94 -31.71 69.59 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.467 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -77.33 -29.12 53.35 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.43 0.692 . . . . 0.0 111.224 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -48.05 58.45 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.411 0.685 . . . . 0.0 109.35 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 26.9 p -61.81 -39.0 90.23 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.281 176.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.2 tp -57.62 -52.15 66.58 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.685 0.794 . . . . 0.0 111.325 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -68.78 -61.7 1.7 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.495 -175.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.6 mt -51.69 -35.68 43.65 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.78 0.675 . . . . 0.0 111.89 -176.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 66' ' ' SER . 60.8 ttt180 -55.81 -44.42 77.84 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.004 1.322 . . . . 0.0 112.816 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -100.17 -54.61 2.83 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.191 0.596 . . . . 0.0 111.619 -178.056 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -51.99 -48.7 64.3 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.239 1.416 . . . . 0.0 112.413 -176.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -116.59 -12.2 10.97 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.208 0.603 . . . . 0.0 111.884 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 84.44 -11.22 59.27 Favored Glycine 0 N--CA 1.473 1.161 0 CA-C-O 120.046 -0.308 . . . . 0.0 113.465 -176.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.672 HG21 HG13 ' A' ' 95' ' ' VAL . 50.6 t -71.7 92.52 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 124.514 1.125 . . . . 0.0 109.989 -174.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.9 t -117.66 166.1 12.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.272 0.629 . . . . 0.0 110.936 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.22 65.79 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.575 0.547 . . . . 0.0 113.027 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.408 HG11 HG12 ' A' ' 75' ' ' VAL . 27.3 m -98.8 8.94 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.086 0.955 . . . . 0.0 111.75 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.404 ' HA ' HD12 ' A' ' 82' ' ' LEU . 6.8 p-10 -58.38 -33.38 69.54 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.622 1.169 . . . . 0.0 111.509 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -58.71 -57.83 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.68 1.192 . . . . 0.0 110.958 175.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG3' HD11 ' A' ' 94' ' ' LEU . 9.6 pt-20 -77.42 -19.66 55.76 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.03 -174.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 79' ' ' ASP . 34.8 mt -64.41 -39.64 94.25 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.046 0.938 . . . . 0.0 110.233 169.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -67.84 -35.65 78.96 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.484 173.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.51 -4.21 47.46 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.481 0.712 . . . . 0.0 112.744 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 91' ' ' LEU . 87.4 mt -74.91 140.69 43.96 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.776 0.43 . . . . 0.0 111.476 177.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -128.36 -0.1 5.68 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.222 1.009 . . . . 0.0 109.666 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p -155.09 140.03 17.3 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.305 1.042 . . . . 0.0 110.868 -170.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.3 t -75.77 -33.2 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.025 0.93 . . . . 0.0 111.329 -174.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.58 -38.31 87.09 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.155 0.502 . . . . 0.0 110.705 176.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.29 -29.48 68.27 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.962 0.905 . . . . 0.0 111.528 174.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.505 ' HB2' HD13 ' A' ' 85' ' ' LEU . 33.7 tp -66.72 -38.72 87.27 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.647 0.379 . . . . 0.0 111.553 171.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -61.39 -48.1 82.8 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 174.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -62.85 -30.02 71.19 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.702 0.801 . . . . 0.0 112.447 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.559 HD11 ' HG3' ' A' ' 81' ' ' GLU . 7.1 tt -61.27 -58.18 9.31 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.385 1.074 . . . . 0.0 109.206 175.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 HG21 ' A' ' 75' ' ' VAL . 96.4 t -63.92 -40.37 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.966 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.69 -35.78 80.94 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.711 0.804 . . . . 0.0 111.309 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -66.71 -46.6 75.01 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -72.09 -24.31 61.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.715 0.806 . . . . 0.0 111.456 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -76.3 -34.0 59.07 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.05 -18.91 38.03 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.543 0.737 . . . . 0.0 111.354 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 64.73 9.79 5.5 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 125.291 1.437 . . . . 0.0 112.059 -172.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 60.61 36.2 91.01 Favored Glycine 0 C--N 1.359 1.824 0 C-N-CA 123.212 0.434 . . . . 0.0 113.058 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 123.428 0.691 . . . . 0.0 110.448 -176.568 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.656 0.265 . . . . 0.0 110.666 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.35 173.81 13.47 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.159 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.5 p -161.85 130.42 4.29 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.053 0.941 . . . . 0.0 109.65 177.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.1 m -82.82 93.83 7.53 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.534 0.733 . . . . 0.0 110.217 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -87.31 123.98 32.87 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.063 0.545 . . . . 0.0 109.89 178.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -72.25 127.31 32.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.054 0.541 . . . . 0.0 109.843 174.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -140.16 147.06 39.6 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -125.03 158.39 33.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.185 0.594 . . . . 0.0 110.535 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -143.21 110.97 5.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.433 1.093 . . . . 0.0 108.633 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -75.5 103.59 5.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.1 p -126.86 147.22 50.06 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.893 0.877 . . . . 0.0 110.559 -177.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -81.18 119.32 23.45 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.5 0.72 . . . . 0.0 109.261 176.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -82.52 59.43 4.93 Favored Glycine 0 C--N 1.349 1.305 0 C-N-CA 122.979 0.323 . . . . 0.0 112.816 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -101.14 12.71 37.09 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 124.071 0.948 . . . . 0.0 110.031 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -73.44 86.22 1.53 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.998 0.919 . . . . 0.0 110.077 -178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.4 t30 64.98 166.62 0.17 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.808 1.243 . . . . 0.0 111.084 -177.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -151.06 117.27 5.62 Favored 'General case' 0 C--O 1.24 0.605 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -79.68 89.76 5.17 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -63.49 -55.16 26.29 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.177 0.591 . . . . 0.0 109.914 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -150.97 175.88 11.65 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -54.55 -40.89 71.6 Favored Glycine 0 C--N 1.359 1.855 0 O-C-N 123.208 0.318 . . . . 0.0 113.012 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -81.28 109.44 15.79 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 171.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.8 ptt? -106.92 152.38 40.92 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.482 1.113 . . . . 0.0 109.488 176.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -54.07 155.33 15.44 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.087 2.525 . . . . 0.0 113.103 174.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 m120 66.43 101.08 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.003 1.321 . . . . 0.0 109.341 -170.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -78.59 172.0 14.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.009 0.923 . . . . 0.0 110.482 -177.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -30.48 68.86 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.292 0.637 . . . . 0.0 110.071 174.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -60.42 -46.35 90.31 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 124.11 0.964 . . . . 0.0 111.423 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.13 -37.32 87.06 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.807 0.692 . . . . 0.0 110.469 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.471 ' O ' HG23 ' A' ' 34' ' ' VAL . 27.5 m170 -72.89 -30.36 63.89 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.455 0.702 . . . . 0.0 110.734 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.48 -34.65 65.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.151 0.98 . . . . 0.0 108.848 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.15 -31.81 70.73 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.579 175.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.5 m -70.13 -38.84 75.63 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.004 0.922 . . . . 0.0 110.243 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 30' ' ' HIS . 67.5 t -57.87 -50.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.207 0.603 . . . . 0.0 109.713 174.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 81.9 mt -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.005 0.922 . . . . 0.0 112.078 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.4 t -64.26 -48.58 75.2 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.132 0.573 . . . . 0.0 110.661 178.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -77.97 -23.18 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.862 0.865 . . . . 0.0 110.841 -177.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.52 ' HB1' HG13 ' A' ' 61' ' ' VAL . . . -79.38 -42.89 24.55 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.435 0.694 . . . . 0.0 111.014 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.3 p -80.52 -53.58 6.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.391 0.676 . . . . 0.0 110.593 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 123.3 -23.57 6.79 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.853 -174.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.2 m -87.14 149.83 48.26 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 123.582 0.753 . . . . 0.0 109.764 176.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.473 ' HG2' ' HG2' ' A' ' 45' ' ' GLU . 69.6 Cg_endo -71.22 165.88 31.01 Favored 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 122.394 2.063 . . . . 0.0 112.164 179.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.15 -26.97 66.7 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.714 0.806 . . . . 0.0 111.406 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.04 -33.33 75.21 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.643 0.777 . . . . 0.0 111.739 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 42' ' ' PRO . 13.2 mm-40 -84.91 -18.86 33.36 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.241 0.616 . . . . 0.0 111.734 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.9 mt -97.6 154.19 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.78 0.832 . . . . 0.0 109.66 179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 t -155.68 177.13 11.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -59.07 -40.99 86.91 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -79.99 81.34 6.27 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.458 -1.246 . . . . 0.0 108.497 176.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.1 t -162.1 113.95 1.68 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-N 114.278 -1.328 . . . . 0.0 108.388 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -68.37 108.66 3.32 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.54 ' SD ' ' HB3' ' A' ' 56' ' ' ALA . 50.6 ttm -73.47 76.55 1.43 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.206 1.402 . . . . 0.0 110.461 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -123.72 16.32 9.48 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.974 0.909 . . . . 0.0 109.852 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -157.55 -44.68 0.07 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.456 1.102 . . . . 0.0 109.663 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.409 ' H ' HD12 ' A' ' 55' ' ' LEU . 5.0 mp -69.51 -30.26 68.08 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.927 -170.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' SD ' ' A' ' 52' ' ' MET . . . -154.84 39.37 0.43 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.238 0.615 . . . . 0.0 110.374 179.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -106.83 -30.96 8.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.855 -176.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.53 140.84 58.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.398 0.679 . . . . 0.0 110.738 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -54.14 -43.54 70.63 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.179 0.992 . . . . 0.0 113.464 -173.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 tt -68.36 -39.0 81.95 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.52 HG13 ' HB1' ' A' ' 38' ' ' ALA . 36.4 t -69.34 -32.9 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 122.984 0.514 . . . . 0.0 111.243 -179.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.9 -40.47 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.246 0.618 . . . . 0.0 109.816 175.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 33.7 m -64.89 -47.64 77.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.031 176.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.21 -41.18 83.45 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.706 1.202 . . . . 0.0 110.482 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.466 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 40.8 tp -64.66 -50.98 64.94 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.29 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -55.48 -47.58 75.91 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.012 0.925 . . . . 0.0 111.966 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 63' ' ' SER . 87.9 mt -66.39 -35.53 80.57 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.457 0.703 . . . . 0.0 111.27 -178.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.9 tppt? -73.42 -40.98 63.83 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 123.64 0.587 . . . . 0.0 110.468 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 65' ' ' LEU . 87.0 mt -65.9 -36.34 83.12 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.579 0.752 . . . . 0.0 110.2 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 ttp85 -62.46 -51.0 69.23 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.553 1.141 . . . . 0.0 110.966 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.05 -49.37 51.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.466 -174.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -88.15 -53.54 4.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.567 0.747 . . . . 0.0 111.53 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 69' ' ' LEU . 92.8 m-85 -94.59 -13.54 25.86 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.31 0.644 . . . . 0.0 112.155 -171.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.1 5.05 90.02 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 116.915 -0.129 . . . . 0.0 113.106 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.44 HG21 HG13 ' A' ' 95' ' ' VAL . 75.9 t -81.95 111.29 18.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.036 0.934 . . . . 0.0 109.512 -179.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.7 p -62.52 171.55 1.93 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.089 0.955 . . . . 0.0 112.293 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.7 92.49 0.01 OUTLIER Glycine 0 C--N 1.358 1.755 0 O-C-N 124.147 0.904 . . . . 0.0 113.353 -177.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 81' ' ' GLU . 8.9 m -104.39 37.61 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.371 1.068 . . . . 0.0 110.663 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.55 -41.31 66.33 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.429 1.092 . . . . 0.0 112.29 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -62.93 -44.7 95.35 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.77 0.828 . . . . 0.0 110.609 176.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 78' ' ' VAL . 25.7 mm-40 -64.92 -31.88 73.33 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.955 178.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 76.0 mt -71.73 -36.72 70.56 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.168 0.587 . . . . 0.0 111.731 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -75.83 -23.2 55.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 110.661 -0.126 . . . . 0.0 110.661 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 81' ' ' GLU . 89.6 mt -68.55 -19.55 64.5 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.3 0.64 . . . . 0.0 111.882 171.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' GLU . 29.3 mt -82.6 150.66 26.74 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.956 0.503 . . . . 0.0 110.111 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -136.12 -6.1 2.09 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.044 0.938 . . . . 0.0 109.594 175.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.2 m -141.64 154.32 45.3 Favored 'General case' 0 C--O 1.246 0.897 0 C-N-CA 123.027 0.531 . . . . 0.0 110.277 -174.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.04 -32.12 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 123.727 0.811 . . . . 0.0 111.42 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.67 -49.44 67.98 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.074 0.55 . . . . 0.0 110.72 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.01 -37.74 83.6 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.295 -176.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.5 tp -67.29 -47.87 69.33 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.358 0.412 . . . . 0.0 111.848 176.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -59.59 -43.84 93.57 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.556 0.742 . . . . 0.0 111.778 -176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.7 -31.21 57.08 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 123.14 0.275 . . . . 0.0 111.479 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 32.3 tp -62.15 -51.23 68.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.984 0.513 . . . . 0.0 110.403 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.44 HG13 HG21 ' A' ' 75' ' ' VAL . 81.1 t -65.47 -42.02 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.847 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -63.65 -45.78 88.6 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 123.672 0.607 . . . . 0.0 111.373 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -73.82 -28.23 61.51 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.212 0.605 . . . . 0.0 111.49 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -81.33 -19.97 41.68 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.681 0.392 . . . . 0.0 110.789 175.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -81.78 -30.63 32.24 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 174.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.5 -30.56 29.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.812 0.845 . . . . 0.0 110.668 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -136.02 89.36 2.48 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.07 0.948 . . . . 0.0 108.798 178.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.02 77.71 1.3 Allowed Glycine 0 C--N 1.352 1.459 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.338 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 CA--C 1.559 1.301 0 C-N-CA 125.24 1.416 . . . . 0.0 110.697 -177.585 . . . . . . . . 0 0 . 1 stop_ save_