data_5wod_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 5wod _Structure_validation_residue.Date_analyzed 2017-09-29 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 ' 1' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 48.1 Cg_exo -57.71 -44.03 44.78 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.185 2.59 . . . . 0.0 113.543 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.442 ' O ' ' HG3' ' A' ' 7' ' ' GLN . 44.4 mt-10 -61.52 -45.22 95.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.001 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.94 -33.66 64.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.804 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -62.58 -44.39 96.43 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.51 98.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.835 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 3' ' ' GLU . 92.0 mt-30 -68.84 -46.48 68.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.0 111.015 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.468 HD23 ' HB2' ' A' ' 30' ' ' ALA . 75.3 mt -71.78 -39.62 69.82 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 58.3 tp -67.61 -41.92 83.21 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 120.534 0.207 . . . . 0.0 111.223 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.9 p -67.73 -33.08 74.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.078 0.466 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.43 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -66.23 -38.46 87.95 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.935 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -42.91 99.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.242 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 49.2 mt-10 -64.83 -41.51 95.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -66.47 -36.4 82.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.39 86.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.079 0.466 . . . . 0.0 110.461 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.28 -44.42 75.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.052 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 52.5 mt-10 -67.53 -34.86 77.94 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.824 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.4 tp -82.81 -17.33 44.43 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.025 0.44 . . . . 0.0 110.46 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.35 32.18 62.7 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.711 176.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.2 m -92.5 105.52 14.68 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 116.86 0.33 . . . . 0.0 110.48 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.402 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 30.3 Cg_endo -64.09 -42.07 20.02 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.631 2.22 . . . . 0.0 113.369 -177.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.6 -43.69 75.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.137 0.494 . . . . 0.0 110.454 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.21 -38.79 65.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.823 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 21' ' ' PRO . 13.1 ptm180 -61.18 -38.62 87.16 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.0 96.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.947 0.403 . . . . 0.0 110.898 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -74.6 -40.93 61.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.235 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 11' ' ' ALA . 78.8 mt -72.43 -41.2 66.44 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -176.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.83 -42.09 90.98 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.767 -0.373 . . . . 0.0 111.213 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 p -67.23 -37.45 83.59 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 110.29 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.468 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -63.44 -39.1 93.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.002 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.57 93.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.675 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.93 -33.51 61.99 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.958 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 55.4 tptt -66.25 -42.3 88.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.721 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.423 ' HB3' HD12 ' A' ' 8' ' ' LEU . . . -61.26 -35.93 78.63 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.488 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.54 -39.86 85.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.167 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -63.07 -33.08 74.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.584 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.7 mt -78.09 -14.88 59.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.673 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.498 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.441 -1.017 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.753 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 120.488 0.185 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.9 Cg_exo -63.92 -37.89 41.48 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.027 2.484 . . . . 0.0 113.387 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.73 -44.76 92.62 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.95 0.405 . . . . 0.0 110.52 -178.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -68.82 -41.44 78.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.28 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -62.27 -46.33 89.28 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.475 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.77 98.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.787 0.327 . . . . 0.0 111.421 -178.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.7 -44.59 66.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 30' ' ' ALA . 85.2 mt -70.91 -36.4 72.69 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 tp -68.86 -43.97 74.3 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 120.717 0.294 . . . . 0.0 110.94 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.7 p -64.02 -30.43 71.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.934 0.397 . . . . 0.0 110.341 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -60.91 -36.15 78.52 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.579 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.09 -44.89 96.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.876 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 0.8 OUTLIER -70.68 -37.65 73.66 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.161 177.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.606 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 64.7 tttm -64.26 -43.03 96.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.854 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.03 -34.94 77.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.038 0.447 . . . . 0.0 109.974 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -65.43 -44.29 87.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.579 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 53.1 mt-10 -62.44 -33.4 74.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.832 178.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -82.43 -13.5 56.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.73 37.16 46.01 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.855 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.6 m -113.1 91.87 19.95 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-O 120.75 0.31 . . . . 0.0 110.328 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -64.82 -41.8 17.03 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.017 2.478 . . . . 0.0 113.159 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.29 -43.53 86.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.345 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -37.47 78.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.761 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.49 -42.53 96.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.076 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.42 91.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.018 0.437 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -71.29 -40.14 71.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.471 HD21 ' CB ' ' A' ' 11' ' ' ALA . 67.5 mt -67.63 -33.09 74.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.078 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -64.86 -37.41 87.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.106 0.479 . . . . 0.0 110.404 176.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.0 m -66.75 -39.27 87.86 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.602 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB3' HD22 ' A' ' 8' ' ' LEU . . . -64.35 -38.88 92.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.793 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.87 -43.22 94.84 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.4 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.93 -39.48 69.41 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.254 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.87 -49.85 76.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.785 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.465 ' HB2' HD11 ' A' ' 8' ' ' LEU . . . -61.67 -35.62 78.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -67.64 -39.31 84.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.42 . . . . 0.0 110.484 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -66.25 -32.2 73.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.784 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.09 -14.57 60.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.782 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.545 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.013 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.45 -44.44 27.49 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.317 2.678 . . . . 0.0 114.256 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.51 -45.69 86.17 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.927 0.394 . . . . 0.0 109.988 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -68.88 -38.33 79.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.572 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -62.19 -45.97 91.02 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.541 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.57 98.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.069 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.19 -47.44 67.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.999 0.428 . . . . 0.0 111.363 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.465 HD23 ' HB2' ' A' ' 30' ' ' ALA . 81.5 mt -71.83 -37.41 70.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 35.7 tp -69.03 -44.31 72.97 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.376 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 31.4 p -66.15 -32.79 74.45 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.025 0.441 . . . . 0.0 110.324 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.35 96.91 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.635 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.422 ' HB2' ' CD2' ' A' ' 28' ' ' LEU . . . -61.04 -40.62 94.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.533 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 47.0 mt-10 -64.89 -39.83 94.14 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.327 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.498 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 60.9 tttm -65.94 -35.73 81.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.838 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.451 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -64.84 -34.68 78.94 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.084 0.469 . . . . 0.0 110.069 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -66.6 -40.81 89.02 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.81 -28.97 70.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.202 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.8 mt -81.52 -16.6 51.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.164 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.71 34.68 42.9 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.936 -0.65 . . . . 0.0 113.168 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.4 p -117.22 91.68 37.61 Favored Pre-proline 0 C--N 1.319 -0.756 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 -43.73 52.53 Favored 'Trans proline' 0 N--CA 1.48 0.715 0 C-N-CA 123.431 2.754 . . . . 0.0 114.848 -175.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 42.2 tt0 -70.44 -44.72 67.26 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.044 -177.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -66.83 -34.63 78.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -62.96 -44.3 96.43 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.977 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.21 99.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.559 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 50.9 mm-40 -68.08 -41.31 82.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.212 0.53 . . . . 0.0 110.301 -179.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.451 HD23 ' HB3' ' A' ' 15' ' ' ALA . 9.7 tp -72.82 -33.78 66.41 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.642 -179.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.424 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 13.0 mt -67.33 -33.76 75.93 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 120.805 0.336 . . . . 0.0 110.191 175.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.7 m -63.83 -36.71 84.81 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.465 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -64.62 -40.55 95.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.916 175.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.41 -43.71 96.45 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.065 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 43.5 mt-10 -71.89 -33.12 68.08 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.15 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -63.02 -47.4 83.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.519 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.444 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.915 0.388 . . . . 0.0 110.28 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.17 -45.4 93.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.287 176.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -66.35 -32.64 74.15 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.024 178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -13.98 59.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.619 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.513 -179.513 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.452 0.168 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.44 -36.25 67.21 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.587 2.191 . . . . 0.0 111.522 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -63.44 -44.94 93.1 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.432 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.12 -42.67 62.66 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.196 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -61.62 -46.08 91.33 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.655 -177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.16 95.42 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.832 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -72.76 -45.76 56.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 111.89 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' A' ' 30' ' ' ALA . 95.2 mt -71.54 -36.81 71.1 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.4 tp -69.36 -40.92 77.21 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.4 p -66.74 -33.02 74.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.967 0.413 . . . . 0.0 110.209 178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.444 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -63.73 -37.37 87.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.994 176.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.11 93.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.995 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 41.7 mt-10 -70.09 -41.86 73.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.397 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.566 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 17.1 tppt? -63.84 -36.6 84.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.92 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 24' ' ' ARG . . . -61.34 -39.43 90.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.051 0.453 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.0 -39.28 79.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 64.5 mm-40 -64.79 -22.81 67.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.646 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 87.1 mt -83.55 -16.25 46.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.688 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.65 20.74 79.74 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.889 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.2 t -109.2 103.54 52.72 Favored Pre-proline 0 C--N 1.32 -0.699 0 O-C-N 122.827 -0.22 . . . . 0.0 110.42 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -38.16 45.38 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.71 2.273 . . . . 0.0 113.082 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.12 -45.05 95.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.841 0.353 . . . . 0.0 110.75 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.52 -33.47 62.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.594 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.495 ' O ' HD13 ' A' ' 28' ' ' LEU . 59.6 ttp180 -60.13 -45.3 93.49 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.236 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -41.44 93.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.838 0.351 . . . . 0.0 110.94 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -67.77 -43.26 80.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.14 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.444 HD22 ' HB2' ' A' ' 11' ' ' ALA . 51.1 mt -73.01 -33.04 65.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.738 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 24' ' ' ARG . 8.3 mp -66.12 -31.81 72.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 110.253 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 50.2 m -64.71 -44.08 91.37 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.5 ' HB3' HD21 ' A' ' 8' ' ' LEU . . . -63.58 -40.33 96.67 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.755 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.07 -40.5 89.71 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.134 0.492 . . . . 0.0 110.157 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -70.96 -40.97 71.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.466 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.467 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 33.8 mmtp -61.49 -41.14 96.82 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.324 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.451 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -60.44 -39.83 88.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.952 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -66.42 -42.92 87.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.717 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -62.38 -32.43 73.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.779 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 78.4 mt -77.02 -15.44 59.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.71 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.397 -179.089 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 120.447 0.165 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.85 -34.53 81.97 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.889 2.393 . . . . 0.0 111.242 177.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.64 -44.92 95.05 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.91 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -73.92 -37.7 64.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.942 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.433 ' NH2' ' HA ' ' A' ' 35' ' ' ASP . 42.2 ttm-85 -61.93 -47.22 85.9 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.443 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.62 -44.23 97.38 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -71.39 -45.0 63.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.529 HD23 ' HB2' ' A' ' 30' ' ' ALA . 98.4 mt -71.79 -41.2 68.59 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.71 -39.92 76.59 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -176.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.0 p -64.35 -32.02 73.47 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.939 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.475 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.11 -37.78 86.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.549 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.15 99.45 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.06 -41.63 77.32 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.833 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 87.7 tttt -64.67 -41.65 95.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.671 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.36 -34.93 77.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.657 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -68.25 -41.49 81.07 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.102 0.477 . . . . 0.0 110.045 178.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.42 -33.12 74.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.39 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.3 mt -81.85 -9.12 59.7 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.007 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.538 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.96 36.13 72.89 Favored Glycine 0 N--CA 1.441 -0.985 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.844 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.5 m -106.16 92.92 7.2 Favored Pre-proline 0 C--N 1.321 -0.633 0 C-N-CA 122.138 0.175 . . . . 0.0 110.695 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 23.4 Cg_exo -65.3 -42.35 13.57 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.614 2.209 . . . . 0.0 112.48 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -67.46 -44.28 78.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -72.34 -36.94 68.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -64.26 -36.45 84.14 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.453 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.19 92.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.032 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -71.58 -41.81 68.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.595 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.475 HD21 ' CB ' ' A' ' 11' ' ' ALA . 89.1 mt -68.45 -34.31 75.73 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.743 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -67.81 -34.81 77.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.849 0.357 . . . . 0.0 110.643 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.6 m -66.51 -35.61 80.68 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.529 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -64.89 -41.51 95.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.978 176.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.14 80.09 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.231 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 7.0 tp10 -71.64 -40.91 69.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.146 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.4 ttmt -66.06 -35.85 81.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.09 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' HA ' ' A' ' 5' ' ' ARG . . . -62.02 -36.86 82.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.721 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.433 ' HA ' ' NH2' ' A' ' 5' ' ' ARG . 25.0 t70 -65.8 -41.21 92.21 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.538 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 36.3 mt-10 -69.03 -25.73 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.302 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 85.0 mt -81.88 -15.36 54.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.811 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.399 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.401 -179.016 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.535 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 33.2 Cg_exo -61.06 -44.42 24.47 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.957 2.438 . . . . 0.0 112.883 -177.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -66.43 -44.57 82.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.86 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.24 -33.85 67.84 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.743 0.306 . . . . 0.0 110.562 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -62.36 -46.1 90.19 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.831 178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.85 -42.96 99.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.429 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.47 -44.14 79.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.487 HD22 ' CB ' ' A' ' 30' ' ' ALA . 50.1 mt -70.52 -36.58 73.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.567 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 tp -67.01 -43.71 82.18 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.703 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.7 p -67.95 -32.16 72.41 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.956 0.407 . . . . 0.0 110.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.49 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.36 -37.49 85.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.013 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.14 90.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.834 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 40.3 tt0 -70.01 -41.29 74.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.26 177.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -63.65 -43.45 96.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.942 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.03 76.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.936 0.398 . . . . 0.0 110.248 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.28 -41.74 80.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.656 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 29.6 mm-40 -62.26 -33.31 74.38 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.964 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -87.76 -0.46 56.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.412 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.12 36.99 94.2 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.529 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.1 m -105.02 95.07 8.57 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.51 -42.32 21.9 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.818 2.345 . . . . 0.0 113.767 -177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -66.66 -44.56 81.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.053 0.454 . . . . 0.0 110.642 -178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -72.03 -35.82 69.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -62.06 -44.18 97.23 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.647 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.41 -43.7 96.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.119 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -42.52 84.38 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.144 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.49 HD23 ' CB ' ' A' ' 11' ' ' ALA . 56.2 mt -69.58 -37.92 77.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.534 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 25.7 mt -64.37 -36.64 84.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 0.0 110.277 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.425 HG23 ' HE3' ' A' ' 33' ' ' LYS . 50.4 m -70.74 -37.79 73.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.6 177.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.487 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -62.91 -35.96 81.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.61 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.54 94.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.145 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 47.9 mt-10 -72.24 -39.66 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.873 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.425 ' HE3' HG23 ' A' ' 29' ' ' THR . 96.8 mttt -63.32 -40.36 97.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.456 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB3' HD11 ' A' ' 8' ' ' LEU . . . -67.37 -35.01 78.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.368 0.604 . . . . 0.0 109.816 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.66 -39.94 95.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.64 178.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 46.2 mt-10 -62.98 -33.98 76.55 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.241 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.97 -13.84 59.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.003 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.535 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.798 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.074 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.496 0.188 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.57 -44.7 10.48 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.897 2.398 . . . . 0.0 113.422 -177.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.73 -41.3 75.49 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 120.804 0.335 . . . . 0.0 111.109 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.39 -40.9 94.02 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -62.98 -40.75 98.69 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.328 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.57 96.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -69.64 -44.7 70.07 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.066 0.46 . . . . 0.0 111.051 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.481 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.8 mt -71.05 -37.78 72.52 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.05 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 11.6 tp -67.43 -44.26 79.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.034 -178.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -64.02 -37.41 87.31 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.333 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.92 -38.75 92.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.132 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.27 96.9 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.966 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 46.9 mm-40 -64.62 -40.82 96.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.453 178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.63 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -66.45 -45.66 79.03 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.872 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.79 78.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.79 -38.12 88.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.945 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -71.7 -29.2 64.3 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.64 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 72.5 mt -81.33 -16.28 52.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.639 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.51 26.37 61.32 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.546 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.6 t -103.28 104.42 40.84 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.43 -41.86 30.76 Favored 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.888 2.392 . . . . 0.0 113.445 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.27 -44.83 95.64 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.881 0.372 . . . . 0.0 111.478 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -74.79 -38.98 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.581 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -60.13 -44.74 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.269 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.12 82.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.965 0.412 . . . . 0.0 111.186 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -65.85 -41.74 91.31 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.76 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.487 HD23 ' CB ' ' A' ' 11' ' ' ALA . 56.7 mt -74.17 -37.4 63.99 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.257 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.7 mt -64.5 -40.64 96.02 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.403 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.9 p -69.43 -32.58 71.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.01 0.433 . . . . 0.0 110.322 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.481 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -67.18 -40.88 86.65 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.083 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.91 -42.97 95.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.232 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -71.7 -33.6 68.93 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 40.7 ttmt -64.05 -49.81 70.88 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.639 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -61.64 -34.75 76.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.145 0.498 . . . . 0.0 110.339 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.05 -41.17 99.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.081 177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -66.02 -31.78 72.88 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.44 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.1 mt -75.94 -13.55 60.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.376 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.059 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.883 -179.297 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 26.0 Cg_exo -63.91 -44.36 13.3 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.019 2.479 . . . . 0.0 112.98 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.36 -43.69 92.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.866 0.365 . . . . 0.0 111.219 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.25 -39.35 65.5 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.372 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -61.77 -43.53 98.68 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.9 -42.95 99.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.232 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -70.97 -44.61 65.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.882 0.372 . . . . 0.0 111.38 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 30' ' ' ALA . 67.4 mt -70.12 -39.05 75.67 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.157 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.87 -40.58 79.19 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.236 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 13.8 p -67.32 -34.11 76.68 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.362 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.494 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.66 -39.75 94.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.903 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.97 94.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.963 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 34.0 tt0 -70.56 -41.36 72.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.172 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -63.92 -44.17 93.71 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.565 0.221 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.8 78.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.969 0.414 . . . . 0.0 109.961 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.35 -45.6 79.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.231 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 50.3 mt-10 -62.08 -34.73 76.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.627 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -82.29 -7.82 59.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.958 0.408 . . . . 0.0 111.483 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.56 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 76.15 32.43 52.46 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.105 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -101.36 95.64 5.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.56 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 21.9 Cg_exo -65.23 -42.6 13.08 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.87 2.38 . . . . 0.0 113.282 -176.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -69.58 -44.16 71.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.772 0.32 . . . . 0.0 110.868 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.3 -38.95 88.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.223 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -60.57 -45.17 94.93 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.14 94.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.788 0.328 . . . . 0.0 111.267 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -67.79 -40.84 83.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.494 HD22 ' CB ' ' A' ' 11' ' ' ALA . 65.4 mt -70.02 -35.57 74.45 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.145 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.5 mt -66.53 -32.01 73.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.329 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -62.79 -40.89 98.74 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.505 ' HB3' HD21 ' A' ' 8' ' ' LEU . . . -70.78 -38.66 73.41 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.228 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.12 94.13 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.689 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -72.83 -37.45 67.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.734 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -68.7 -48.6 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.748 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.19 -34.6 72.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.559 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.83 -42.4 98.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.336 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -63.78 -35.75 81.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.582 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.46 -14.66 59.64 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 120.992 0.425 . . . . 0.0 110.867 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.656 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.433 -1.541 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.652 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.441 0.162 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.6 Cg_exo -63.86 -44.08 14.28 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.024 2.483 . . . . 0.0 113.488 -177.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.45 -44.5 90.92 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.867 0.365 . . . . 0.0 110.611 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -66.14 -35.67 81.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.037 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.9 -43.86 97.64 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.445 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.05 -42.65 98.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.947 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -69.78 -44.01 70.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 111.441 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.533 HD22 ' HB3' ' A' ' 30' ' ' ALA . 86.6 mt -70.44 -39.14 74.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.1 tp -69.1 -41.11 77.9 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.741 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.5 p -64.46 -32.82 74.61 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.596 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.481 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -64.51 -38.05 89.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.175 176.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -44.3 96.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.828 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -66.63 -39.68 88.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.286 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -68.07 -33.65 74.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.284 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.938 0.399 . . . . 0.0 110.362 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.16 -41.91 85.21 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.6 -34.72 76.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.509 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.63 -17.48 41.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.931 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.89 33.38 65.95 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.072 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -105.87 101.25 32.24 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.958 0.379 . . . . 0.0 110.699 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.19 -39.99 44.6 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.069 2.513 . . . . 0.0 114.346 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.37 -43.25 86.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.125 0.488 . . . . 0.0 110.624 -177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.52 -38.75 62.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.324 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -59.62 -44.66 93.36 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.02 -178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.65 93.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.008 -179.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -68.82 -42.26 77.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.976 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.481 HD23 ' CB ' ' A' ' 11' ' ' ALA . 66.6 mt -67.1 -34.42 77.59 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.537 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 19.9 mt -67.01 -39.41 87.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.334 176.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.2 m -65.52 -35.17 80.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.069 0.461 . . . . 0.0 109.836 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.533 ' HB3' HD22 ' A' ' 8' ' ' LEU . . . -63.16 -39.07 93.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.196 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.92 97.94 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.212 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.537 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 37.4 mt-10 -71.95 -39.81 69.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.035 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.498 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 88.6 tttt -65.12 -40.54 94.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.419 ' HB1' HD13 ' A' ' 8' ' ' LEU . . . -60.13 -35.18 74.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.568 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.13 -44.51 91.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.168 176.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.64 -29.49 69.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.148 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 68.1 mt -78.92 -14.57 59.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.681 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.537 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.446 -0.664 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.294 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.54 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 16.6 m . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.18 -44.22 12.83 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.918 2.412 . . . . 0.0 113.679 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.557 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 37.7 tt0 -65.88 -43.79 87.3 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.892 -177.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.54 ' OE1' ' HB3' ' A' ' 1' ' ' SER . 20.0 mp0 -65.19 -39.5 92.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 58.0 ttp180 -62.03 -45.2 94.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.82 99.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.665 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 71.1 mm-40 -63.81 -43.15 97.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.059 0.456 . . . . 0.0 110.74 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 30' ' ' ALA . 45.7 mt -70.5 -40.38 73.59 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.372 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -68.7 -40.08 80.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.472 -178.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.547 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 6.2 p -64.41 -37.35 87.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.861 0.362 . . . . 0.0 110.114 177.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.525 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.83 -36.97 84.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.425 177.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 9' ' ' LEU . . . -60.32 -40.75 91.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.567 177.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -68.79 -41.26 78.97 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.394 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.596 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 29.2 mtpp -64.22 -44.69 91.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.323 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.9 -37.12 86.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.993 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.57 -44.2 78.76 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.959 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.15 -31.78 72.3 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.522 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 54.3 mt -82.76 -9.34 59.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.22 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.71 39.69 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.755 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 m -114.48 92.04 26.82 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.784 0.326 . . . . 0.0 110.743 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.84 -42.19 15.77 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.118 2.545 . . . . 0.0 113.118 -177.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 11.3 mp0 -62.43 -43.79 97.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.728 0.299 . . . . 0.0 110.678 -178.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.89 -39.54 79.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.042 0.449 . . . . 0.0 110.138 178.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -60.07 -43.6 95.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.665 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.12 88.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.408 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 58.6 mm-40 -72.12 -37.09 69.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.09 0.472 . . . . 0.0 110.899 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 11' ' ' ALA . 43.8 mt -73.27 -36.21 66.31 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.072 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.3 mt -67.21 -39.5 86.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.206 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.2 p -70.98 -32.82 69.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.153 0.502 . . . . 0.0 110.388 178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.486 ' HB2' HD21 ' A' ' 8' ' ' LEU . . . -63.19 -40.43 97.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.287 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -40.57 88.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.409 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.65 -39.79 80.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.244 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -68.43 -40.88 81.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.655 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.84 -35.26 79.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.476 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.44 -36.97 84.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.312 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.53 -33.05 74.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.158 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.9 -14.29 59.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.818 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.022 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.617 -178.232 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 CA--C 1.54 0.573 0 CA-C-O 120.591 0.234 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.3 Cg_exo -63.82 -45.33 11.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.148 2.565 . . . . 0.0 113.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.27 -44.22 88.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.467 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -66.29 -39.71 89.55 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.962 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -64.33 -39.51 94.05 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.146 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.71 -42.59 93.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.827 0.346 . . . . 0.0 111.322 -177.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -69.57 -44.13 71.47 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.491 HD23 ' HB2' ' A' ' 30' ' ' ALA . 88.8 mt -70.4 -37.7 74.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.281 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.3 tp -68.9 -39.71 79.55 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -67.48 -32.49 73.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.919 0.39 . . . . 0.0 110.303 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.456 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.81 -40.42 97.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.87 175.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.857 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -64.72 -41.21 96.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.161 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.4 ' O ' HD21 ' A' ' 18' ' ' LEU . 84.5 tttt -64.51 -45.82 85.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.994 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.417 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -65.99 -34.96 79.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -68.39 -38.95 81.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.01 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -66.95 -35.26 79.57 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.83 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.4 HD21 ' O ' ' A' ' 14' ' ' LYS . 4.1 mm? -81.03 -11.76 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.3 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.74 24.84 73.49 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.919 178.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.6 t -95.27 101.98 8.66 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.14 -43.0 12.23 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.806 2.337 . . . . 0.0 114.532 -173.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -71.36 -43.3 67.19 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.442 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.74 -35.06 78.06 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.277 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -61.54 -43.97 97.9 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.122 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -43.62 98.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.776 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -65.92 -43.02 89.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.775 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.456 HD22 ' CB ' ' A' ' 11' ' ' ALA . 83.5 mt -73.28 -35.85 66.22 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.844 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.5 mt -67.58 -33.61 75.37 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.755 0.312 . . . . 0.0 110.511 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.9 m -63.82 -40.83 97.55 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.491 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -66.67 -39.84 88.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.628 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -43.82 95.35 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.246 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 64.5 mm-40 -73.09 -39.68 65.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.156 177.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.7 tptt -54.54 -55.69 26.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.953 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.401 ' HB3' HD12 ' A' ' 8' ' ' LEU . . . -60.87 -34.55 74.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.099 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.02 -42.33 97.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.113 177.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 57.5 mm-40 -65.67 -34.17 77.59 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.319 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 73.3 mt -76.67 -14.8 59.94 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.583 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.445 -0.728 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.59 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.739 0.304 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -63.94 -34.84 58.22 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.057 2.505 . . . . 0.0 112.09 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.08 -44.38 89.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.182 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -70.53 -33.9 71.68 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.66 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -62.37 -42.06 99.1 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.706 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.44 -42.92 99.5 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.923 0.392 . . . . 0.0 110.867 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.75 -40.6 88.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.211 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.512 HD22 ' CB ' ' A' ' 30' ' ' ALA . 53.1 mt -69.83 -37.94 76.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.445 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -65.39 -41.22 93.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.243 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -72.0 -32.18 66.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.939 0.4 . . . . 0.0 110.229 177.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.38 -37.76 86.98 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.436 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.423 ' HB2' ' CD2' ' A' ' 28' ' ' LEU . . . -60.76 -43.82 97.53 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.726 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.91 -33.88 72.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.339 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -65.13 -46.11 82.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.869 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.79 -36.32 83.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.957 0.408 . . . . 0.0 110.799 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.14 -41.24 94.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.863 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.09 -34.49 78.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.866 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.09 -11.84 58.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.03 34.79 29.24 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.046 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.1 m -111.19 90.82 12.2 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.04 -42.04 15.25 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.788 2.325 . . . . 0.0 113.353 -176.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.7 -43.14 80.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.607 0.241 . . . . 0.0 110.795 -177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.72 -38.62 87.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.51 -44.88 95.56 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.673 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.87 90.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.268 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -69.28 -40.94 77.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.487 HD21 ' CB ' ' A' ' 11' ' ' ALA . 61.8 mt -68.58 -33.52 74.2 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.155 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.423 ' CD2' ' HB2' ' A' ' 12' ' ' ALA . 44.5 mt -66.32 -42.98 87.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.22 177.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.3 p -65.69 -31.78 72.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.86 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.512 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -62.9 -34.38 77.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.9 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.67 92.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.857 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.6 -40.29 66.64 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.972 0.415 . . . . 0.0 111.019 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.593 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 61.3 mmtt -65.12 -35.04 79.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.919 -178.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.413 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -62.24 -35.57 79.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.686 0.279 . . . . 0.0 110.901 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -67.65 -42.49 82.15 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.02 -33.36 75.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.678 177.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.6 mt -76.92 -14.46 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.87 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.47 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 25.7 Cg_exo -63.09 -41.96 25.7 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.081 2.52 . . . . 0.0 113.556 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.72 -46.15 69.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.767 0.318 . . . . 0.0 111.15 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.8 -34.0 73.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.542 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.72 -45.33 93.23 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.739 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.68 -42.21 98.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.798 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -63.38 -44.48 94.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.852 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.546 HD23 ' CB ' ' A' ' 30' ' ' ALA . 55.8 mt -70.03 -40.6 75.07 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.614 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.6 mt -67.08 -36.08 81.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.984 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 14.2 p -71.99 -36.77 69.85 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.94 177.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.517 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.54 -37.35 85.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.164 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.32 97.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.724 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -69.75 -41.07 75.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.286 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 32.4 mmtp -66.24 -40.55 90.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.597 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.07 -35.09 79.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.409 . . . . 0.0 110.384 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.85 -40.77 88.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.888 177.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -65.12 -28.39 69.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.325 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 85.0 mt -82.24 -11.18 58.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.718 178.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.76 50.08 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.724 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -114.54 91.84 26.34 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.33 -39.82 27.91 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.843 2.362 . . . . 0.0 112.802 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 33.0 tt0 -67.12 -43.17 83.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.723 0.297 . . . . 0.0 110.505 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -64.49 -42.2 96.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -60.73 -43.03 98.41 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.461 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.95 97.59 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.063 0.459 . . . . 0.0 111.155 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 90.6 mt-30 -65.73 -41.14 92.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.517 HD23 ' CB ' ' A' ' 11' ' ' ALA . 37.6 mt -73.54 -36.18 65.64 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.739 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.413 ' O ' ' HB1' ' A' ' 31' ' ' ALA . 29.3 mt -66.73 -37.48 84.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.416 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -70.94 -31.85 68.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.158 0.504 . . . . 0.0 110.082 177.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.546 ' CB ' HD23 ' A' ' 8' ' ' LEU . . . -64.61 -35.2 80.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 28' ' ' LEU . . . -59.25 -39.21 82.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.72 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -69.49 -40.38 77.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.892 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -61.69 -49.23 77.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.837 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.419 ' HB3' HD11 ' A' ' 8' ' ' LEU . . . -65.12 -35.27 80.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.407 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.17 -46.67 87.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.514 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.91 -27.13 67.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.14 0.495 . . . . 0.0 110.321 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -76.77 -14.65 59.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.896 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.536 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.617 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.909 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.77 -42.34 20.52 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.888 2.392 . . . . 0.0 113.892 -175.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -67.66 -46.11 73.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.021 0.439 . . . . 0.0 111.264 -177.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.13 -32.83 71.01 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.819 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.9 ttt-85 -61.5 -46.2 91.01 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.955 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.6 -43.24 94.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.59 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -66.35 -42.83 87.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.687 0.28 . . . . 0.0 111.682 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.526 HD22 ' CB ' ' A' ' 30' ' ' ALA . 68.5 mt -69.63 -38.31 77.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.727 0.298 . . . . 0.0 111.514 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.408 ' HG ' ' HB3' ' A' ' 31' ' ' ALA . 11.6 mt -67.45 -38.85 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.867 178.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -72.0 -32.81 67.55 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.577 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.489 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.39 -37.33 85.31 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.827 176.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -60.86 -44.55 96.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.285 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.12 -40.61 71.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.109 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.34 -37.2 86.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.537 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -37.98 88.63 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.479 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.61 -41.6 96.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.78 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.22 -34.79 75.69 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.612 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.3 tp -90.06 0.14 57.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.284 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.64 -92.99 1.51 Allowed Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -177.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 23' ' ' GLU . 36.1 m 25.32 70.18 0.39 Allowed Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.116 1.366 . . . . 0.0 113.769 175.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.3 -41.86 46.82 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.407 2.071 . . . . 0.0 112.78 -177.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.24 -44.23 63.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.917 0.389 . . . . 0.0 111.283 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 20' ' ' CYS . 31.5 mt-10 -66.08 -34.86 79.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.152 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 67.3 ttt180 -61.03 -43.47 98.84 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.184 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.25 95.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.566 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.29 -41.9 99.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.658 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 11' ' ' ALA . 48.2 mt -68.92 -38.35 79.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.055 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 37.1 mt -65.69 -32.51 74.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.0 m -68.04 -40.28 82.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.731 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.526 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -64.18 -35.76 81.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.685 177.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.408 ' HB3' ' HG ' ' A' ' 9' ' ' LEU . . . -59.27 -43.27 92.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.861 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -72.69 -39.45 67.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 ttmt -63.12 -45.64 91.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.897 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.04 -34.94 79.62 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.049 0.452 . . . . 0.0 110.225 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.28 -43.72 97.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.409 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.99 -30.53 71.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.971 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.3 mt -76.91 -13.41 59.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.991 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.007 0 C-N-CA 120.688 -0.767 . . . . 0.0 111.823 -178.561 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -58.84 -44.31 36.85 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.133 2.555 . . . . 0.0 113.638 -177.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -64.59 -42.93 95.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.842 0.354 . . . . 0.0 111.41 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -73.38 -34.3 65.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.274 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -62.34 -45.1 94.73 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.992 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.77 99.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.274 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -68.66 -44.88 73.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.923 -179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.502 HD21 ' CB ' ' A' ' 30' ' ' ALA . 81.7 mt -70.52 -36.42 73.73 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.916 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 22.1 tp -68.85 -40.79 79.15 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.944 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.5 p -68.19 -32.8 73.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.122 0.487 . . . . 0.0 110.043 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.457 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -62.63 -37.23 85.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.86 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 9' ' ' LEU . . . -60.73 -40.91 94.09 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.545 177.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 31.2 mt-10 -70.25 -34.45 72.85 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.079 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.469 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 55.2 mttp -63.5 -44.8 93.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.593 0.235 . . . . 0.0 110.915 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.55 78.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.123 0.487 . . . . 0.0 109.798 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -64.03 -42.65 97.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.574 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 24.2 mm-40 -62.01 -34.32 75.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.836 177.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -81.55 -15.97 53.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.798 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.37 33.31 48.95 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.793 179.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -113.82 97.79 45.57 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.046 0.451 . . . . 0.0 110.944 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.14 -37.04 86.49 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 123.123 2.549 . . . . 0.0 113.341 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.54 -46.0 90.38 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.779 0.323 . . . . 0.0 111.204 -176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -76.43 -35.3 58.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.862 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -60.75 -43.25 98.21 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.322 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.71 95.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.651 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -65.37 -42.89 92.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 11' ' ' ALA . 60.2 mt -71.38 -35.78 71.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.654 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.1 mt -66.16 -34.4 77.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.922 0.391 . . . . 0.0 110.414 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.5 m -64.78 -36.84 85.61 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.419 0.628 . . . . 0.0 109.361 176.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.502 ' CB ' HD21 ' A' ' 8' ' ' LEU . . . -69.45 -38.68 77.91 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.641 178.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.49 93.75 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.903 177.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -70.75 -40.48 72.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.625 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -64.72 -43.19 94.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.015 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' HD11 ' A' ' 8' ' ' LEU . . . -63.62 -35.14 79.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.457 . . . . 0.0 110.434 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.06 -42.87 84.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.258 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -63.47 -35.4 80.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.036 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.473 ' O ' HD12 ' A' ' 37' ' ' LEU . 1.9 tm? -77.1 -14.89 59.74 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.221 0.534 . . . . 0.0 110.13 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.824 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.92 -179.474 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 110.555 -0.165 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.562 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.1 Cg_exo -64.14 -45.07 10.74 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.797 2.332 . . . . 0.0 113.019 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 59.2 mm-40 -68.22 -42.94 79.04 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.709 0.29 . . . . 0.0 111.145 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -66.01 -39.68 90.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.426 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -62.24 -43.49 98.71 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.323 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.87 -42.91 98.83 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.121 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.8 mm100 -70.01 -44.39 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.939 0.399 . . . . 0.0 111.379 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' ' 30' ' ' ALA . 79.2 mt -71.09 -38.31 72.41 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.34 -178.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.38 -44.01 79.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 120.644 0.259 . . . . 0.0 111.066 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.8 p -67.15 -32.66 73.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.511 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.41 -37.41 85.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.248 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.56 -39.22 87.18 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.791 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.54 -39.68 73.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.269 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -64.61 -45.14 88.17 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.912 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -61.78 -36.32 80.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.924 0.393 . . . . 0.0 110.814 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.81 -44.76 84.71 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.192 0.52 . . . . 0.0 109.615 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.22 -31.68 72.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.056 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 95.3 mt -82.46 -16.01 50.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.518 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.98 29.86 27.48 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.227 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.5 m -102.72 97.84 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.77 -43.86 9.03 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.36 2.04 . . . . 0.0 113.435 -176.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.52 -42.92 64.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.029 0.442 . . . . 0.0 110.594 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.78 -34.26 77.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.017 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 24' ' ' ARG . 29.2 ttm180 -59.91 -44.73 94.12 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -39.26 77.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.941 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -63.26 -42.49 99.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.095 0.474 . . . . 0.0 110.556 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.511 HD21 ' CB ' ' A' ' 11' ' ' ALA . 57.6 mt -75.3 -35.84 61.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.922 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.5 mt -64.18 -39.35 93.8 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 p -70.96 -34.63 71.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.944 0.402 . . . . 0.0 110.075 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -63.76 -35.82 81.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.447 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.95 90.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.76 177.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -71.66 -40.12 69.86 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.905 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 65.2 mttm -57.19 -54.8 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.426 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.83 -35.89 79.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.89 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.05 -42.36 89.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.405 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.94 -33.59 76.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.169 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.8 mt -79.41 -14.45 58.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.386 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.562 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.781 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.207 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.36 -38.38 43.75 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.97 2.447 . . . . 0.0 112.787 -177.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -69.45 -44.04 72.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 0.0 110.282 -178.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -66.63 -36.68 83.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.805 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.494 ' HD3' ' OD1' ' A' ' 35' ' ' ASP . 8.8 ttm180 -61.68 -46.44 89.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.642 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.92 -39.91 91.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.19 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -64.86 -45.75 84.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.723 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.553 ' HB3' ' HA ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER -71.66 -43.77 65.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 5' ' ' ARG . 10.5 mp -62.35 -37.85 87.27 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.412 -178.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 21.9 p -72.09 -32.45 67.03 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.274 176.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.477 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -62.36 -37.46 85.75 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.612 177.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.85 97.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.603 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.17 -37.2 78.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.395 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 68.5 mttm -64.75 -36.44 84.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.634 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.428 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -66.22 -35.38 80.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.984 177.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.29 -43.14 99.37 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.809 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -67.25 -34.76 78.14 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.756 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 76.8 mt -81.88 -17.59 46.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.096 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.84 28.82 71.5 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 113.016 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 23' ' ' GLU . 4.0 p -105.14 102.17 34.77 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.906 0.384 . . . . 0.0 111.168 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.78 -41.71 67.03 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.264 2.643 . . . . 0.0 113.62 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.86 -44.81 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.334 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.429 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 34.7 mt-10 -69.63 -36.13 75.85 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.975 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -60.97 -44.37 97.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.77 97.9 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.87 0.367 . . . . 0.0 111.181 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.85 -41.13 71.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.235 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.477 HD23 ' HB3' ' A' ' 11' ' ' ALA . 78.2 mt -67.39 -34.34 77.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.717 0.294 . . . . 0.0 111.091 178.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.2 mt -69.49 -32.49 71.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.545 175.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.8 m -67.75 -43.95 78.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.426 ' C ' ' HG ' ' A' ' 8' ' ' LEU . . . -63.31 -39.27 94.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.351 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.553 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . . . -62.03 -44.53 96.5 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.158 0.504 . . . . 0.0 110.42 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 5.7 tp10 -67.29 -39.5 85.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.01 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -66.28 -41.02 90.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.216 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' HD22 ' A' ' 8' ' ' LEU . . . -62.25 -36.73 82.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.317 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' OD1' ' HD3' ' A' ' 5' ' ' ARG . 4.5 m-20 -60.87 -41.88 96.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.734 176.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 38.0 mt-10 -70.38 -33.48 71.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.375 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.85 -14.23 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.738 0.304 . . . . 0.0 111.255 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.436 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.385 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -61.48 -44.36 22.92 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.038 2.492 . . . . 0.0 114.227 -173.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.82 -45.11 75.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.025 0.441 . . . . 0.0 110.461 -177.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.78 -34.96 76.44 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.516 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.472 ' O ' HD21 ' A' ' 9' ' ' LEU . 35.6 ttp180 -62.53 -47.75 82.52 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.994 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.85 95.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.137 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -68.97 -45.28 71.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.563 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.495 HD21 ' CB ' ' A' ' 30' ' ' ALA . 58.9 mt -70.63 -41.67 71.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.472 HD21 ' O ' ' A' ' 5' ' ' ARG . 4.2 mm? -63.0 -42.55 99.88 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-O 120.769 0.319 . . . . 0.0 111.03 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.9 p -70.1 -35.17 73.96 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.189 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.477 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.45 -38.94 91.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.246 177.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -43.85 98.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.281 0.562 . . . . 0.0 109.502 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 13.9 mm-40 -68.02 -40.8 82.85 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.372 179.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 96.5 mttt -67.81 -37.63 82.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.412 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.1 -35.15 79.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.138 0.495 . . . . 0.0 109.945 176.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.411 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 16.3 t70 -63.76 -44.65 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.374 175.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 96.3 mt-10 -65.75 -28.77 69.28 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.333 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 47.7 mt -82.84 -11.78 57.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.855 0.36 . . . . 0.0 111.086 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.36 50.38 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.363 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.5 m -116.28 89.07 25.03 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.59 -37.13 38.93 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.703 2.269 . . . . 0.0 112.73 -177.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -64.57 -43.88 92.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.568 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -73.59 -34.64 65.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.311 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -60.02 -43.91 94.96 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.423 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.887 0.375 . . . . 0.0 110.836 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.83 -40.13 94.69 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.338 0.589 . . . . 0.0 110.308 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.477 HD23 ' CB ' ' A' ' 11' ' ' ALA . 45.0 mt -74.7 -34.64 62.67 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.198 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.3 mt -65.27 -42.4 93.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.301 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 p -64.22 -36.1 82.98 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.25 0.548 . . . . 0.0 109.941 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.495 ' CB ' HD21 ' A' ' 8' ' ' LEU . . . -69.3 -40.41 77.71 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.315 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.73 97.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.727 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -66.34 -40.03 89.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.892 -178.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -73.11 -35.11 66.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.06 89.69 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.834 0.35 . . . . 0.0 110.971 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -63.21 -47.51 82.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.801 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.0 -21.18 61.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.949 0.404 . . . . 0.0 111.112 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.26 -15.69 59.96 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.279 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.578 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.721 179.277 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 120.948 0.404 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -57.39 -34.62 98.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.945 2.43 . . . . 0.0 112.83 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.15 -44.01 93.45 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.862 0.363 . . . . 0.0 110.853 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -72.27 -35.68 68.81 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.441 ' HA ' ' CB ' ' A' ' 34' ' ' ALA . 56.3 ttp180 -62.38 -46.18 89.8 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.897 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.01 97.85 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.91 0.386 . . . . 0.0 110.892 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -67.59 -46.08 73.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.282 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.48 HD21 ' HB2' ' A' ' 30' ' ' ALA . 65.8 mt -72.26 -40.41 67.68 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.53 -41.92 88.01 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.411 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 15.6 p -64.11 -38.12 89.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.371 . . . . 0.0 110.297 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -64.23 -38.67 91.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.168 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.13 -42.67 99.47 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.935 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.82 -41.35 91.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.569 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 10' ' ' THR . 97.5 mttt -63.85 -44.43 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.68 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.36 -43.52 85.79 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.948 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.405 ' OD1' ' HD2' ' A' ' 24' ' ' ARG . 17.9 t70 -59.17 -42.99 92.09 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.019 0.438 . . . . 0.0 110.963 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.97 -35.07 77.4 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.523 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.2 tp -93.31 -17.0 24.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.95 0.405 . . . . 0.0 111.551 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.19 -99.91 1.57 Allowed Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.0 m 42.21 79.68 0.32 Allowed Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 123.543 0.737 . . . . 0.0 111.801 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.56 -43.87 53.94 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 122.736 2.291 . . . . 0.0 113.896 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -74.11 -43.45 57.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.88 0.372 . . . . 0.0 111.633 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.24 -43.24 74.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.502 -177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.405 ' HD2' ' OD1' ' A' ' 16' ' ' ASP . 9.5 ttp180 -62.18 -44.37 96.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.635 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.91 96.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.574 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -73.18 -38.89 65.99 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.941 -178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.471 HD21 ' CB ' ' A' ' 11' ' ' ALA . 70.7 mt -70.73 -38.32 73.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.702 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.08 -39.63 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.664 0.269 . . . . 0.0 111.36 178.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -71.0 -33.22 70.19 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.865 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.48 ' HB2' HD21 ' A' ' 8' ' ' LEU . . . -64.19 -36.04 82.78 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.372 176.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.22 96.02 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.847 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -71.97 -40.33 68.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.899 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.553 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 69.1 mmtt -66.91 -36.45 82.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.545 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.444 ' HB2' HD11 ' A' ' 8' ' ' LEU . . . -63.21 -41.6 99.17 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.155 0.502 . . . . 0.0 110.387 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.56 -38.12 83.67 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.553 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.44 -33.62 74.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.491 177.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 95.6 mt -76.68 -15.48 59.78 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.126 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.004 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.787 -179.804 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.445 -0.713 0 CA-C-O 120.68 0.276 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.18 -40.67 31.7 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.968 2.445 . . . . 0.0 113.493 -177.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 13.8 tp10 -64.3 -44.89 90.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.14 0.495 . . . . 0.0 109.888 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -65.96 -41.78 90.79 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.25 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.9 ttm105 -61.87 -46.86 87.6 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.409 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.62 93.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 79.4 mm-40 -70.04 -44.8 68.47 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.491 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.5 mt -71.21 -37.12 72.1 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.5 tp -69.28 -42.93 74.84 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 120.587 0.232 . . . . 0.0 111.387 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -64.98 -32.83 74.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.705 0.288 . . . . 0.0 110.89 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.419 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -63.92 -42.62 97.33 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.164 0.506 . . . . 0.0 109.642 176.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.13 -44.21 97.13 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.385 177.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -66.4 -41.09 89.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -65.37 -44.34 87.9 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.08 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.02 85.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -59.57 -37.54 78.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.116 0.484 . . . . 0.0 111.075 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -61.35 -34.71 75.74 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.856 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -93.33 -0.53 56.62 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.707 0.765 . . . . 0.0 110.163 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.84 -101.19 2.68 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.7 m 38.47 70.75 1.22 Allowed Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 123.594 0.758 . . . . 0.0 111.615 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -55.66 -42.92 62.7 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.578 2.185 . . . . 0.0 113.579 -174.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -72.24 -38.2 68.98 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.457 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -72.39 -43.54 63.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.369 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -64.31 -36.59 84.61 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.117 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.71 -44.42 96.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 111.267 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.51 -39.35 74.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.662 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD21 ' CB ' ' A' ' 11' ' ' ALA . 64.8 mt -67.84 -39.54 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.063 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.434 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 26.5 mt -64.4 -36.99 85.94 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.834 177.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.633 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 87.6 m -63.57 -41.96 98.35 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 176.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.491 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.68 -36.07 81.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.384 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.95 95.88 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.9 176.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 36.8 mt-10 -70.55 -40.27 73.49 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.63 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 29' ' ' THR . 30.4 mmmt -64.11 -42.73 96.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.925 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.47 ' HB1' HD13 ' A' ' 8' ' ' LEU . . . -60.62 -35.88 77.24 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.817 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.42 -38.41 84.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.585 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.19 -26.6 67.48 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.19 0.519 . . . . 0.0 110.615 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 70.8 mt -77.3 -14.54 59.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.34 177.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.631 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 48.1 Cg_exo -57.71 -44.03 44.78 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.185 2.59 . . . . 0.0 113.543 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.442 ' O ' ' HG3' ' A' ' 7' ' ' GLN . 44.4 mt-10 -61.52 -45.22 95.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.001 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.94 -33.66 64.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.804 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -62.58 -44.39 96.43 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.51 98.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.835 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 3' ' ' GLU . 92.0 mt-30 -68.84 -46.48 68.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.0 111.015 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.468 HD23 ' HB2' ' A' ' 30' ' ' ALA . 75.3 mt -71.78 -39.62 69.82 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 58.3 tp -67.61 -41.92 83.21 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 120.534 0.207 . . . . 0.0 111.223 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.9 p -67.73 -33.08 74.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.078 0.466 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.43 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -66.23 -38.46 87.95 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.935 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -42.91 99.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.242 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 49.2 mt-10 -64.83 -41.51 95.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -66.47 -36.4 82.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.41 -38.39 86.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.079 0.466 . . . . 0.0 110.461 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.28 -44.42 75.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.052 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 52.5 mt-10 -67.53 -34.86 77.94 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.824 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.4 tp -82.81 -17.33 44.43 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.025 0.44 . . . . 0.0 110.46 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.35 32.18 62.7 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.711 176.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.2 m -92.5 105.52 14.68 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 116.86 0.33 . . . . 0.0 110.48 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.402 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 30.3 Cg_endo -64.09 -42.07 20.02 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.631 2.22 . . . . 0.0 113.369 -177.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.6 -43.69 75.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.137 0.494 . . . . 0.0 110.454 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.21 -38.79 65.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.823 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 21' ' ' PRO . 13.1 ptm180 -61.18 -38.62 87.16 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.0 96.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.947 0.403 . . . . 0.0 110.898 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -74.6 -40.93 61.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.235 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 11' ' ' ALA . 78.8 mt -72.43 -41.2 66.44 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -176.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.83 -42.09 90.98 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.767 -0.373 . . . . 0.0 111.213 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 p -67.23 -37.45 83.59 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 110.29 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.468 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -63.44 -39.1 93.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.002 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.57 93.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.675 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.93 -33.51 61.99 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.958 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 55.4 tptt -66.25 -42.3 88.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.721 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.423 ' HB3' HD12 ' A' ' 8' ' ' LEU . . . -61.26 -35.93 78.63 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.488 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.54 -39.86 85.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.167 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -63.07 -33.08 74.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.584 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.7 mt -78.09 -14.88 59.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.673 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.498 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.441 -1.017 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.753 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 120.488 0.185 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.9 Cg_exo -63.92 -37.89 41.48 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.027 2.484 . . . . 0.0 113.387 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.73 -44.76 92.62 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.95 0.405 . . . . 0.0 110.52 -178.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -68.82 -41.44 78.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.28 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -62.27 -46.33 89.28 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.475 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.77 98.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.787 0.327 . . . . 0.0 111.421 -178.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.7 -44.59 66.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 30' ' ' ALA . 85.2 mt -70.91 -36.4 72.69 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 tp -68.86 -43.97 74.3 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 120.717 0.294 . . . . 0.0 110.94 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.7 p -64.02 -30.43 71.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.934 0.397 . . . . 0.0 110.341 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -60.91 -36.15 78.52 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.579 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.09 -44.89 96.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.876 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 0.8 OUTLIER -70.68 -37.65 73.66 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.161 177.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.606 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 64.7 tttm -64.26 -43.03 96.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.854 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.03 -34.94 77.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.038 0.447 . . . . 0.0 109.974 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -65.43 -44.29 87.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.579 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 53.1 mt-10 -62.44 -33.4 74.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.832 178.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -82.43 -13.5 56.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.73 37.16 46.01 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.855 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.6 m -113.1 91.87 19.95 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-O 120.75 0.31 . . . . 0.0 110.328 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -64.82 -41.8 17.03 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.017 2.478 . . . . 0.0 113.159 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.29 -43.53 86.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.345 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -37.47 78.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.761 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.49 -42.53 96.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.076 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.42 91.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.018 0.437 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -71.29 -40.14 71.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.471 HD21 ' CB ' ' A' ' 11' ' ' ALA . 67.5 mt -67.63 -33.09 74.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.078 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -64.86 -37.41 87.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.106 0.479 . . . . 0.0 110.404 176.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.0 m -66.75 -39.27 87.86 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.602 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB3' HD22 ' A' ' 8' ' ' LEU . . . -64.35 -38.88 92.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.793 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.87 -43.22 94.84 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.4 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.93 -39.48 69.41 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.254 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.87 -49.85 76.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.785 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.465 ' HB2' HD11 ' A' ' 8' ' ' LEU . . . -61.67 -35.62 78.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -67.64 -39.31 84.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.42 . . . . 0.0 110.484 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -66.25 -32.2 73.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.784 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.09 -14.57 60.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.782 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.545 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.013 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.45 -44.44 27.49 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.317 2.678 . . . . 0.0 114.256 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.51 -45.69 86.17 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.927 0.394 . . . . 0.0 109.988 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -68.88 -38.33 79.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.572 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -62.19 -45.97 91.02 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.541 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.57 98.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.069 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.19 -47.44 67.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.999 0.428 . . . . 0.0 111.363 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.465 HD23 ' HB2' ' A' ' 30' ' ' ALA . 81.5 mt -71.83 -37.41 70.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 35.7 tp -69.03 -44.31 72.97 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.376 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 31.4 p -66.15 -32.79 74.45 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.025 0.441 . . . . 0.0 110.324 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.35 96.91 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.635 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.422 ' HB2' ' CD2' ' A' ' 28' ' ' LEU . . . -61.04 -40.62 94.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.533 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 47.0 mt-10 -64.89 -39.83 94.14 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.327 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.498 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 60.9 tttm -65.94 -35.73 81.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.838 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.451 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -64.84 -34.68 78.94 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.084 0.469 . . . . 0.0 110.069 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -66.6 -40.81 89.02 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.81 -28.97 70.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.202 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.8 mt -81.52 -16.6 51.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.164 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.71 34.68 42.9 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.936 -0.65 . . . . 0.0 113.168 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.4 p -117.22 91.68 37.61 Favored Pre-proline 0 C--N 1.319 -0.756 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 -43.73 52.53 Favored 'Trans proline' 0 N--CA 1.48 0.715 0 C-N-CA 123.431 2.754 . . . . 0.0 114.848 -175.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 42.2 tt0 -70.44 -44.72 67.26 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.044 -177.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -66.83 -34.63 78.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -62.96 -44.3 96.43 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.977 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.21 99.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.559 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 50.9 mm-40 -68.08 -41.31 82.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.212 0.53 . . . . 0.0 110.301 -179.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.451 HD23 ' HB3' ' A' ' 15' ' ' ALA . 9.7 tp -72.82 -33.78 66.41 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.642 -179.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.424 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 13.0 mt -67.33 -33.76 75.93 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 120.805 0.336 . . . . 0.0 110.191 175.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.7 m -63.83 -36.71 84.81 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.465 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -64.62 -40.55 95.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.916 175.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.41 -43.71 96.45 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.065 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 43.5 mt-10 -71.89 -33.12 68.08 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.15 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -63.02 -47.4 83.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.519 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.444 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.915 0.388 . . . . 0.0 110.28 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.17 -45.4 93.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.287 176.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -66.35 -32.64 74.15 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.024 178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -13.98 59.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.619 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.513 -179.513 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.452 0.168 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.44 -36.25 67.21 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.587 2.191 . . . . 0.0 111.522 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -63.44 -44.94 93.1 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.432 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.12 -42.67 62.66 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.196 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -61.62 -46.08 91.33 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.655 -177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.16 95.42 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.832 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -72.76 -45.76 56.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 111.89 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' A' ' 30' ' ' ALA . 95.2 mt -71.54 -36.81 71.1 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.4 tp -69.36 -40.92 77.21 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.4 p -66.74 -33.02 74.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.967 0.413 . . . . 0.0 110.209 178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.444 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -63.73 -37.37 87.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.994 176.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.11 93.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.995 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 41.7 mt-10 -70.09 -41.86 73.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.397 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.566 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 17.1 tppt? -63.84 -36.6 84.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.92 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 24' ' ' ARG . . . -61.34 -39.43 90.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.051 0.453 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.0 -39.28 79.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 64.5 mm-40 -64.79 -22.81 67.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.646 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 87.1 mt -83.55 -16.25 46.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.688 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.65 20.74 79.74 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.889 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.2 t -109.2 103.54 52.72 Favored Pre-proline 0 C--N 1.32 -0.699 0 O-C-N 122.827 -0.22 . . . . 0.0 110.42 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -38.16 45.38 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.71 2.273 . . . . 0.0 113.082 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.12 -45.05 95.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.841 0.353 . . . . 0.0 110.75 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.52 -33.47 62.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.594 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.495 ' O ' HD13 ' A' ' 28' ' ' LEU . 59.6 ttp180 -60.13 -45.3 93.49 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.236 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -41.44 93.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.838 0.351 . . . . 0.0 110.94 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -67.77 -43.26 80.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.14 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.444 HD22 ' HB2' ' A' ' 11' ' ' ALA . 51.1 mt -73.01 -33.04 65.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.738 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 24' ' ' ARG . 8.3 mp -66.12 -31.81 72.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 110.253 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 50.2 m -64.71 -44.08 91.37 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.5 ' HB3' HD21 ' A' ' 8' ' ' LEU . . . -63.58 -40.33 96.67 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.755 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.07 -40.5 89.71 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.134 0.492 . . . . 0.0 110.157 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -70.96 -40.97 71.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.466 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.467 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 33.8 mmtp -61.49 -41.14 96.82 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.324 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.451 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -60.44 -39.83 88.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.952 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -66.42 -42.92 87.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.717 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -62.38 -32.43 73.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.779 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 78.4 mt -77.02 -15.44 59.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.71 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.397 -179.089 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 120.447 0.165 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.85 -34.53 81.97 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.889 2.393 . . . . 0.0 111.242 177.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.64 -44.92 95.05 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.91 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -73.92 -37.7 64.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.942 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.433 ' NH2' ' HA ' ' A' ' 35' ' ' ASP . 42.2 ttm-85 -61.93 -47.22 85.9 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.443 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.62 -44.23 97.38 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -71.39 -45.0 63.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.529 HD23 ' HB2' ' A' ' 30' ' ' ALA . 98.4 mt -71.79 -41.2 68.59 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.71 -39.92 76.59 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -176.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.0 p -64.35 -32.02 73.47 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.939 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.475 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.11 -37.78 86.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.549 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.15 99.45 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.06 -41.63 77.32 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.833 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 87.7 tttt -64.67 -41.65 95.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.671 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.36 -34.93 77.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.657 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -68.25 -41.49 81.07 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.102 0.477 . . . . 0.0 110.045 178.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.42 -33.12 74.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.39 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.3 mt -81.85 -9.12 59.7 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.007 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.538 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.96 36.13 72.89 Favored Glycine 0 N--CA 1.441 -0.985 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.844 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.5 m -106.16 92.92 7.2 Favored Pre-proline 0 C--N 1.321 -0.633 0 C-N-CA 122.138 0.175 . . . . 0.0 110.695 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 23.4 Cg_exo -65.3 -42.35 13.57 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.614 2.209 . . . . 0.0 112.48 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -67.46 -44.28 78.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -72.34 -36.94 68.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -64.26 -36.45 84.14 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.453 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.19 92.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.032 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -71.58 -41.81 68.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.595 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.475 HD21 ' CB ' ' A' ' 11' ' ' ALA . 89.1 mt -68.45 -34.31 75.73 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.743 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -67.81 -34.81 77.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.849 0.357 . . . . 0.0 110.643 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.6 m -66.51 -35.61 80.68 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.529 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -64.89 -41.51 95.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.978 176.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.14 80.09 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.231 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 7.0 tp10 -71.64 -40.91 69.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.146 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.4 ttmt -66.06 -35.85 81.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.09 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' HA ' ' A' ' 5' ' ' ARG . . . -62.02 -36.86 82.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.721 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.433 ' HA ' ' NH2' ' A' ' 5' ' ' ARG . 25.0 t70 -65.8 -41.21 92.21 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.538 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 36.3 mt-10 -69.03 -25.73 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.302 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 85.0 mt -81.88 -15.36 54.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.811 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.399 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.401 -179.016 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.535 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 33.2 Cg_exo -61.06 -44.42 24.47 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.957 2.438 . . . . 0.0 112.883 -177.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -66.43 -44.57 82.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.86 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.24 -33.85 67.84 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.743 0.306 . . . . 0.0 110.562 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -62.36 -46.1 90.19 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.831 178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.85 -42.96 99.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.429 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.47 -44.14 79.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.487 HD22 ' CB ' ' A' ' 30' ' ' ALA . 50.1 mt -70.52 -36.58 73.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.567 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 tp -67.01 -43.71 82.18 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.703 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.7 p -67.95 -32.16 72.41 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.956 0.407 . . . . 0.0 110.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.49 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.36 -37.49 85.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.013 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.14 90.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.834 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 40.3 tt0 -70.01 -41.29 74.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.26 177.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -63.65 -43.45 96.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.942 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.03 76.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.936 0.398 . . . . 0.0 110.248 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.28 -41.74 80.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.656 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 29.6 mm-40 -62.26 -33.31 74.38 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.964 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -87.76 -0.46 56.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.412 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.12 36.99 94.2 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.529 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.1 m -105.02 95.07 8.57 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.51 -42.32 21.9 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.818 2.345 . . . . 0.0 113.767 -177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -66.66 -44.56 81.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.053 0.454 . . . . 0.0 110.642 -178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -72.03 -35.82 69.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -62.06 -44.18 97.23 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.647 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.41 -43.7 96.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.119 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -42.52 84.38 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.144 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.49 HD23 ' CB ' ' A' ' 11' ' ' ALA . 56.2 mt -69.58 -37.92 77.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.534 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 25.7 mt -64.37 -36.64 84.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 0.0 110.277 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.425 HG23 ' HE3' ' A' ' 33' ' ' LYS . 50.4 m -70.74 -37.79 73.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.6 177.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.487 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -62.91 -35.96 81.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.61 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.54 94.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.145 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 47.9 mt-10 -72.24 -39.66 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.873 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.425 ' HE3' HG23 ' A' ' 29' ' ' THR . 96.8 mttt -63.32 -40.36 97.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.456 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB3' HD11 ' A' ' 8' ' ' LEU . . . -67.37 -35.01 78.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.368 0.604 . . . . 0.0 109.816 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.66 -39.94 95.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.64 178.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 46.2 mt-10 -62.98 -33.98 76.55 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.241 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.97 -13.84 59.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.003 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.535 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.798 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.074 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.496 0.188 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.57 -44.7 10.48 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.897 2.398 . . . . 0.0 113.422 -177.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.73 -41.3 75.49 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 120.804 0.335 . . . . 0.0 111.109 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.39 -40.9 94.02 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -62.98 -40.75 98.69 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.328 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.57 96.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -69.64 -44.7 70.07 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.066 0.46 . . . . 0.0 111.051 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.481 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.8 mt -71.05 -37.78 72.52 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.05 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 11.6 tp -67.43 -44.26 79.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.034 -178.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -64.02 -37.41 87.31 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.333 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.92 -38.75 92.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.132 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.27 96.9 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.966 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 46.9 mm-40 -64.62 -40.82 96.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.453 178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.63 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -66.45 -45.66 79.03 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.872 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.79 78.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.79 -38.12 88.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.945 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -71.7 -29.2 64.3 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.64 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 72.5 mt -81.33 -16.28 52.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.639 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.51 26.37 61.32 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.546 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.6 t -103.28 104.42 40.84 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.43 -41.86 30.76 Favored 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.888 2.392 . . . . 0.0 113.445 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.27 -44.83 95.64 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.881 0.372 . . . . 0.0 111.478 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -74.79 -38.98 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.581 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -60.13 -44.74 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.269 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.12 82.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.965 0.412 . . . . 0.0 111.186 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -65.85 -41.74 91.31 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.76 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD23 ' CB ' ' A' ' 11' ' ' ALA . 56.7 mt -74.17 -37.4 63.99 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.257 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.7 mt -64.5 -40.64 96.02 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.403 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.9 p -69.43 -32.58 71.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.01 0.433 . . . . 0.0 110.322 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.481 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -67.18 -40.88 86.65 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.083 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.91 -42.97 95.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.232 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -71.7 -33.6 68.93 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 40.7 ttmt -64.05 -49.81 70.88 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.639 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -61.64 -34.75 76.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.145 0.498 . . . . 0.0 110.339 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.05 -41.17 99.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.081 177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -66.02 -31.78 72.88 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.44 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.1 mt -75.94 -13.55 60.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.376 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.059 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.883 -179.297 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 26.0 Cg_exo -63.91 -44.36 13.3 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.019 2.479 . . . . 0.0 112.98 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.36 -43.69 92.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.866 0.365 . . . . 0.0 111.219 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.25 -39.35 65.5 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.372 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -61.77 -43.53 98.68 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.9 -42.95 99.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.232 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -70.97 -44.61 65.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.882 0.372 . . . . 0.0 111.38 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 30' ' ' ALA . 67.4 mt -70.12 -39.05 75.67 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.157 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.87 -40.58 79.19 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.236 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 13.8 p -67.32 -34.11 76.68 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.362 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.494 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.66 -39.75 94.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.903 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.97 94.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.963 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 34.0 tt0 -70.56 -41.36 72.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.172 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -63.92 -44.17 93.71 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.565 0.221 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.8 78.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.969 0.414 . . . . 0.0 109.961 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.35 -45.6 79.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.231 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 50.3 mt-10 -62.08 -34.73 76.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.627 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -82.29 -7.82 59.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.958 0.408 . . . . 0.0 111.483 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.56 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 76.15 32.43 52.46 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.105 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -101.36 95.64 5.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.56 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 21.9 Cg_exo -65.23 -42.6 13.08 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.87 2.38 . . . . 0.0 113.282 -176.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -69.58 -44.16 71.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.772 0.32 . . . . 0.0 110.868 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.3 -38.95 88.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.223 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -60.57 -45.17 94.93 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.14 94.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.788 0.328 . . . . 0.0 111.267 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -67.79 -40.84 83.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.494 HD22 ' CB ' ' A' ' 11' ' ' ALA . 65.4 mt -70.02 -35.57 74.45 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.145 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.5 mt -66.53 -32.01 73.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.329 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -62.79 -40.89 98.74 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.505 ' HB3' HD21 ' A' ' 8' ' ' LEU . . . -70.78 -38.66 73.41 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.228 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.12 94.13 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.689 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -72.83 -37.45 67.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.734 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -68.7 -48.6 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.748 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.19 -34.6 72.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.559 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.83 -42.4 98.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.336 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -63.78 -35.75 81.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.582 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.46 -14.66 59.64 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 120.992 0.425 . . . . 0.0 110.867 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.656 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.433 -1.541 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.652 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.441 0.162 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.6 Cg_exo -63.86 -44.08 14.28 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.024 2.483 . . . . 0.0 113.488 -177.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.45 -44.5 90.92 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.867 0.365 . . . . 0.0 110.611 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -66.14 -35.67 81.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.037 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.9 -43.86 97.64 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.445 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.05 -42.65 98.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.947 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -69.78 -44.01 70.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 111.441 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.533 HD22 ' HB3' ' A' ' 30' ' ' ALA . 86.6 mt -70.44 -39.14 74.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.1 tp -69.1 -41.11 77.9 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.741 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.5 p -64.46 -32.82 74.61 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.596 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.481 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -64.51 -38.05 89.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.175 176.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -44.3 96.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.828 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -66.63 -39.68 88.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.286 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -68.07 -33.65 74.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.284 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.938 0.399 . . . . 0.0 110.362 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.16 -41.91 85.21 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.6 -34.72 76.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.509 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.63 -17.48 41.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.931 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.89 33.38 65.95 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.072 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -105.87 101.25 32.24 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.958 0.379 . . . . 0.0 110.699 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.19 -39.99 44.6 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.069 2.513 . . . . 0.0 114.346 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.37 -43.25 86.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.125 0.488 . . . . 0.0 110.624 -177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.52 -38.75 62.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.324 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -59.62 -44.66 93.36 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.02 -178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.65 93.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.008 -179.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -68.82 -42.26 77.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.976 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.481 HD23 ' CB ' ' A' ' 11' ' ' ALA . 66.6 mt -67.1 -34.42 77.59 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 19.9 mt -67.01 -39.41 87.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.334 176.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.2 m -65.52 -35.17 80.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.069 0.461 . . . . 0.0 109.836 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.533 ' HB3' HD22 ' A' ' 8' ' ' LEU . . . -63.16 -39.07 93.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.196 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.92 97.94 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.212 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.537 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 37.4 mt-10 -71.95 -39.81 69.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.035 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.498 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 88.6 tttt -65.12 -40.54 94.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.419 ' HB1' HD13 ' A' ' 8' ' ' LEU . . . -60.13 -35.18 74.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.568 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.13 -44.51 91.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.168 176.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.64 -29.49 69.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.148 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 68.1 mt -78.92 -14.57 59.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.681 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.537 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.446 -0.664 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.294 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.54 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 16.6 m . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.18 -44.22 12.83 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.918 2.412 . . . . 0.0 113.679 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.557 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 37.7 tt0 -65.88 -43.79 87.3 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.892 -177.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.54 ' OE1' ' HB3' ' A' ' 1' ' ' SER . 20.0 mp0 -65.19 -39.5 92.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 58.0 ttp180 -62.03 -45.2 94.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.82 99.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.665 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 71.1 mm-40 -63.81 -43.15 97.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.059 0.456 . . . . 0.0 110.74 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 30' ' ' ALA . 45.7 mt -70.5 -40.38 73.59 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.372 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -68.7 -40.08 80.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.472 -178.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.547 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 6.2 p -64.41 -37.35 87.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.861 0.362 . . . . 0.0 110.114 177.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.525 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.83 -36.97 84.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.425 177.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 9' ' ' LEU . . . -60.32 -40.75 91.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.567 177.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -68.79 -41.26 78.97 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.394 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.596 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 29.2 mtpp -64.22 -44.69 91.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.323 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.9 -37.12 86.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.993 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.57 -44.2 78.76 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.959 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.15 -31.78 72.3 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.522 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 54.3 mt -82.76 -9.34 59.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.22 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.71 39.69 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.755 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 m -114.48 92.04 26.82 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.784 0.326 . . . . 0.0 110.743 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.84 -42.19 15.77 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.118 2.545 . . . . 0.0 113.118 -177.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 11.3 mp0 -62.43 -43.79 97.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.728 0.299 . . . . 0.0 110.678 -178.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.89 -39.54 79.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.042 0.449 . . . . 0.0 110.138 178.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -60.07 -43.6 95.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.665 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.12 88.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.408 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 58.6 mm-40 -72.12 -37.09 69.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.09 0.472 . . . . 0.0 110.899 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 11' ' ' ALA . 43.8 mt -73.27 -36.21 66.31 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.072 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.3 mt -67.21 -39.5 86.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.206 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.2 p -70.98 -32.82 69.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.153 0.502 . . . . 0.0 110.388 178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.486 ' HB2' HD21 ' A' ' 8' ' ' LEU . . . -63.19 -40.43 97.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.287 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -40.57 88.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.409 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.65 -39.79 80.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.244 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -68.43 -40.88 81.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.655 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.84 -35.26 79.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.476 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.44 -36.97 84.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.312 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.53 -33.05 74.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.158 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.9 -14.29 59.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.818 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.022 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.617 -178.232 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 CA--C 1.54 0.573 0 CA-C-O 120.591 0.234 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.3 Cg_exo -63.82 -45.33 11.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.148 2.565 . . . . 0.0 113.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.27 -44.22 88.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.467 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -66.29 -39.71 89.55 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.962 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -64.33 -39.51 94.05 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.146 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.71 -42.59 93.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.827 0.346 . . . . 0.0 111.322 -177.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -69.57 -44.13 71.47 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.491 HD23 ' HB2' ' A' ' 30' ' ' ALA . 88.8 mt -70.4 -37.7 74.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.281 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.3 tp -68.9 -39.71 79.55 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -67.48 -32.49 73.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.919 0.39 . . . . 0.0 110.303 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.456 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.81 -40.42 97.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.87 175.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.857 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -64.72 -41.21 96.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.161 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.4 ' O ' HD21 ' A' ' 18' ' ' LEU . 84.5 tttt -64.51 -45.82 85.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.994 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.417 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -65.99 -34.96 79.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -68.39 -38.95 81.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.01 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -66.95 -35.26 79.57 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.83 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.4 HD21 ' O ' ' A' ' 14' ' ' LYS . 4.1 mm? -81.03 -11.76 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.3 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.74 24.84 73.49 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.919 178.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.6 t -95.27 101.98 8.66 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.14 -43.0 12.23 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.806 2.337 . . . . 0.0 114.532 -173.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -71.36 -43.3 67.19 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.442 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.74 -35.06 78.06 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.277 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -61.54 -43.97 97.9 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.122 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -43.62 98.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.776 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -65.92 -43.02 89.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.775 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.456 HD22 ' CB ' ' A' ' 11' ' ' ALA . 83.5 mt -73.28 -35.85 66.22 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.844 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.5 mt -67.58 -33.61 75.37 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.755 0.312 . . . . 0.0 110.511 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.9 m -63.82 -40.83 97.55 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.491 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -66.67 -39.84 88.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.628 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -43.82 95.35 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.246 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 64.5 mm-40 -73.09 -39.68 65.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.156 177.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.7 tptt -54.54 -55.69 26.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.953 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.401 ' HB3' HD12 ' A' ' 8' ' ' LEU . . . -60.87 -34.55 74.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.099 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.02 -42.33 97.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.113 177.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 57.5 mm-40 -65.67 -34.17 77.59 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.319 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 73.3 mt -76.67 -14.8 59.94 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.583 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.445 -0.728 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.59 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.739 0.304 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -63.94 -34.84 58.22 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.057 2.505 . . . . 0.0 112.09 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.08 -44.38 89.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.182 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -70.53 -33.9 71.68 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.66 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -62.37 -42.06 99.1 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.706 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.44 -42.92 99.5 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.923 0.392 . . . . 0.0 110.867 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.75 -40.6 88.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.211 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.512 HD22 ' CB ' ' A' ' 30' ' ' ALA . 53.1 mt -69.83 -37.94 76.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.445 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -65.39 -41.22 93.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.243 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -72.0 -32.18 66.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.939 0.4 . . . . 0.0 110.229 177.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.38 -37.76 86.98 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.436 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.423 ' HB2' ' CD2' ' A' ' 28' ' ' LEU . . . -60.76 -43.82 97.53 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.726 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.91 -33.88 72.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.339 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -65.13 -46.11 82.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.869 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.79 -36.32 83.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.957 0.408 . . . . 0.0 110.799 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.14 -41.24 94.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.863 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.09 -34.49 78.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.866 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.09 -11.84 58.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.03 34.79 29.24 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.046 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.1 m -111.19 90.82 12.2 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.04 -42.04 15.25 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.788 2.325 . . . . 0.0 113.353 -176.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.7 -43.14 80.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.607 0.241 . . . . 0.0 110.795 -177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.72 -38.62 87.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.51 -44.88 95.56 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.673 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.87 90.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.268 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -69.28 -40.94 77.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD21 ' CB ' ' A' ' 11' ' ' ALA . 61.8 mt -68.58 -33.52 74.2 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.155 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.423 ' CD2' ' HB2' ' A' ' 12' ' ' ALA . 44.5 mt -66.32 -42.98 87.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.22 177.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.3 p -65.69 -31.78 72.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.86 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.512 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -62.9 -34.38 77.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.9 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.67 92.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.857 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.6 -40.29 66.64 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.972 0.415 . . . . 0.0 111.019 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.593 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 61.3 mmtt -65.12 -35.04 79.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.919 -178.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.413 ' HB1' HD12 ' A' ' 8' ' ' LEU . . . -62.24 -35.57 79.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.686 0.279 . . . . 0.0 110.901 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -67.65 -42.49 82.15 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.02 -33.36 75.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.678 177.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.6 mt -76.92 -14.46 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.87 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.47 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 25.7 Cg_exo -63.09 -41.96 25.7 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.081 2.52 . . . . 0.0 113.556 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.72 -46.15 69.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.767 0.318 . . . . 0.0 111.15 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.8 -34.0 73.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.542 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.72 -45.33 93.23 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.739 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.68 -42.21 98.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.798 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -63.38 -44.48 94.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.852 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.546 HD23 ' CB ' ' A' ' 30' ' ' ALA . 55.8 mt -70.03 -40.6 75.07 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.614 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.6 mt -67.08 -36.08 81.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.984 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 14.2 p -71.99 -36.77 69.85 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.94 177.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.517 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.54 -37.35 85.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.164 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.32 97.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.724 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -69.75 -41.07 75.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.286 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 32.4 mmtp -66.24 -40.55 90.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.597 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.07 -35.09 79.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.409 . . . . 0.0 110.384 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.85 -40.77 88.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.888 177.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -65.12 -28.39 69.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.325 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 85.0 mt -82.24 -11.18 58.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.718 178.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.76 50.08 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.724 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -114.54 91.84 26.34 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.33 -39.82 27.91 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.843 2.362 . . . . 0.0 112.802 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 33.0 tt0 -67.12 -43.17 83.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.723 0.297 . . . . 0.0 110.505 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -64.49 -42.2 96.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -60.73 -43.03 98.41 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.461 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.95 97.59 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.063 0.459 . . . . 0.0 111.155 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 90.6 mt-30 -65.73 -41.14 92.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.517 HD23 ' CB ' ' A' ' 11' ' ' ALA . 37.6 mt -73.54 -36.18 65.64 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.739 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.413 ' O ' ' HB1' ' A' ' 31' ' ' ALA . 29.3 mt -66.73 -37.48 84.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.416 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -70.94 -31.85 68.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.158 0.504 . . . . 0.0 110.082 177.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.546 ' CB ' HD23 ' A' ' 8' ' ' LEU . . . -64.61 -35.2 80.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 28' ' ' LEU . . . -59.25 -39.21 82.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.72 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -69.49 -40.38 77.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.892 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -61.69 -49.23 77.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.837 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.419 ' HB3' HD11 ' A' ' 8' ' ' LEU . . . -65.12 -35.27 80.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.407 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.17 -46.67 87.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.514 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.91 -27.13 67.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.14 0.495 . . . . 0.0 110.321 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -76.77 -14.65 59.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.896 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.536 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.617 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.909 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.77 -42.34 20.52 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.888 2.392 . . . . 0.0 113.892 -175.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -67.66 -46.11 73.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.021 0.439 . . . . 0.0 111.264 -177.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.13 -32.83 71.01 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.819 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.9 ttt-85 -61.5 -46.2 91.01 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.955 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.6 -43.24 94.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.59 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -66.35 -42.83 87.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.687 0.28 . . . . 0.0 111.682 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.526 HD22 ' CB ' ' A' ' 30' ' ' ALA . 68.5 mt -69.63 -38.31 77.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.727 0.298 . . . . 0.0 111.514 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.408 ' HG ' ' HB3' ' A' ' 31' ' ' ALA . 11.6 mt -67.45 -38.85 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.867 178.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -72.0 -32.81 67.55 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.577 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.489 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.39 -37.33 85.31 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.827 176.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -60.86 -44.55 96.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.285 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.12 -40.61 71.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.109 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.34 -37.2 86.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.537 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -37.98 88.63 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.479 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.61 -41.6 96.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.78 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.22 -34.79 75.69 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.612 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.3 tp -90.06 0.14 57.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.284 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.64 -92.99 1.51 Allowed Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -177.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 23' ' ' GLU . 36.1 m 25.32 70.18 0.39 Allowed Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.116 1.366 . . . . 0.0 113.769 175.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.3 -41.86 46.82 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.407 2.071 . . . . 0.0 112.78 -177.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.24 -44.23 63.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.917 0.389 . . . . 0.0 111.283 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 20' ' ' CYS . 31.5 mt-10 -66.08 -34.86 79.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.152 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 67.3 ttt180 -61.03 -43.47 98.84 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.184 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.25 95.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.566 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.29 -41.9 99.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.658 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 11' ' ' ALA . 48.2 mt -68.92 -38.35 79.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.055 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 37.1 mt -65.69 -32.51 74.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.0 m -68.04 -40.28 82.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.731 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.526 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -64.18 -35.76 81.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.685 177.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.408 ' HB3' ' HG ' ' A' ' 9' ' ' LEU . . . -59.27 -43.27 92.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.861 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -72.69 -39.45 67.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 ttmt -63.12 -45.64 91.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.897 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.04 -34.94 79.62 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.049 0.452 . . . . 0.0 110.225 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.28 -43.72 97.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.409 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.99 -30.53 71.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.971 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.3 mt -76.91 -13.41 59.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.991 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.007 0 C-N-CA 120.688 -0.767 . . . . 0.0 111.823 -178.561 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -58.84 -44.31 36.85 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.133 2.555 . . . . 0.0 113.638 -177.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -64.59 -42.93 95.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.842 0.354 . . . . 0.0 111.41 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -73.38 -34.3 65.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.274 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -62.34 -45.1 94.73 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.992 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.77 99.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.274 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -68.66 -44.88 73.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.923 -179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.502 HD21 ' CB ' ' A' ' 30' ' ' ALA . 81.7 mt -70.52 -36.42 73.73 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.916 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 22.1 tp -68.85 -40.79 79.15 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.944 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.5 p -68.19 -32.8 73.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.122 0.487 . . . . 0.0 110.043 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.457 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -62.63 -37.23 85.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.86 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 9' ' ' LEU . . . -60.73 -40.91 94.09 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.545 177.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 31.2 mt-10 -70.25 -34.45 72.85 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.079 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.469 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 55.2 mttp -63.5 -44.8 93.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.593 0.235 . . . . 0.0 110.915 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.55 78.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.123 0.487 . . . . 0.0 109.798 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -64.03 -42.65 97.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.574 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 24.2 mm-40 -62.01 -34.32 75.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.836 177.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -81.55 -15.97 53.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.798 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.37 33.31 48.95 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.793 179.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -113.82 97.79 45.57 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.046 0.451 . . . . 0.0 110.944 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.14 -37.04 86.49 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 123.123 2.549 . . . . 0.0 113.341 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.54 -46.0 90.38 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.779 0.323 . . . . 0.0 111.204 -176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -76.43 -35.3 58.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.862 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -60.75 -43.25 98.21 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.322 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.71 95.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.651 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -65.37 -42.89 92.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 11' ' ' ALA . 60.2 mt -71.38 -35.78 71.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.654 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.1 mt -66.16 -34.4 77.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.922 0.391 . . . . 0.0 110.414 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.5 m -64.78 -36.84 85.61 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.419 0.628 . . . . 0.0 109.361 176.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.502 ' CB ' HD21 ' A' ' 8' ' ' LEU . . . -69.45 -38.68 77.91 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.641 178.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.49 93.75 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.903 177.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -70.75 -40.48 72.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.625 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -64.72 -43.19 94.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.015 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' HD11 ' A' ' 8' ' ' LEU . . . -63.62 -35.14 79.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.457 . . . . 0.0 110.434 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.06 -42.87 84.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.258 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -63.47 -35.4 80.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.036 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.473 ' O ' HD12 ' A' ' 37' ' ' LEU . 1.9 tm? -77.1 -14.89 59.74 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.221 0.534 . . . . 0.0 110.13 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.824 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.92 -179.474 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 110.555 -0.165 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.562 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.1 Cg_exo -64.14 -45.07 10.74 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.797 2.332 . . . . 0.0 113.019 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 59.2 mm-40 -68.22 -42.94 79.04 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.709 0.29 . . . . 0.0 111.145 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -66.01 -39.68 90.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.426 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -62.24 -43.49 98.71 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.323 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.87 -42.91 98.83 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.121 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.8 mm100 -70.01 -44.39 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.939 0.399 . . . . 0.0 111.379 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' ' 30' ' ' ALA . 79.2 mt -71.09 -38.31 72.41 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.34 -178.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.38 -44.01 79.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 120.644 0.259 . . . . 0.0 111.066 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.8 p -67.15 -32.66 73.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.511 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -62.41 -37.41 85.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.248 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.56 -39.22 87.18 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.791 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.54 -39.68 73.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.269 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -64.61 -45.14 88.17 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.912 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -61.78 -36.32 80.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.924 0.393 . . . . 0.0 110.814 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.81 -44.76 84.71 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.192 0.52 . . . . 0.0 109.615 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.22 -31.68 72.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.056 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 95.3 mt -82.46 -16.01 50.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.518 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.98 29.86 27.48 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.227 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.5 m -102.72 97.84 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.77 -43.86 9.03 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.36 2.04 . . . . 0.0 113.435 -176.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.52 -42.92 64.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.029 0.442 . . . . 0.0 110.594 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.78 -34.26 77.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.017 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 24' ' ' ARG . 29.2 ttm180 -59.91 -44.73 94.12 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -39.26 77.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.941 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -63.26 -42.49 99.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.095 0.474 . . . . 0.0 110.556 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.511 HD21 ' CB ' ' A' ' 11' ' ' ALA . 57.6 mt -75.3 -35.84 61.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.922 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.5 mt -64.18 -39.35 93.8 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 p -70.96 -34.63 71.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.944 0.402 . . . . 0.0 110.075 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -63.76 -35.82 81.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.447 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.95 90.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.76 177.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -71.66 -40.12 69.86 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.905 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 65.2 mttm -57.19 -54.8 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.426 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.83 -35.89 79.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.89 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.05 -42.36 89.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.405 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.94 -33.59 76.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.169 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.8 mt -79.41 -14.45 58.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.386 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.562 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.781 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.207 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.36 -38.38 43.75 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.97 2.447 . . . . 0.0 112.787 -177.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -69.45 -44.04 72.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 0.0 110.282 -178.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -66.63 -36.68 83.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.805 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.494 ' HD3' ' OD1' ' A' ' 35' ' ' ASP . 8.8 ttm180 -61.68 -46.44 89.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.642 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.92 -39.91 91.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.19 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -64.86 -45.75 84.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.723 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.553 ' HB3' ' HA ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER -71.66 -43.77 65.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 5' ' ' ARG . 10.5 mp -62.35 -37.85 87.27 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.412 -178.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 21.9 p -72.09 -32.45 67.03 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.274 176.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.477 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -62.36 -37.46 85.75 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.612 177.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.85 97.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.603 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.17 -37.2 78.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.395 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 68.5 mttm -64.75 -36.44 84.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.634 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.428 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -66.22 -35.38 80.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.984 177.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.29 -43.14 99.37 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.809 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -67.25 -34.76 78.14 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.756 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 76.8 mt -81.88 -17.59 46.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.096 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.84 28.82 71.5 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 113.016 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 23' ' ' GLU . 4.0 p -105.14 102.17 34.77 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.906 0.384 . . . . 0.0 111.168 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.78 -41.71 67.03 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.264 2.643 . . . . 0.0 113.62 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.86 -44.81 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.334 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.429 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 34.7 mt-10 -69.63 -36.13 75.85 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.975 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -60.97 -44.37 97.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.77 97.9 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.87 0.367 . . . . 0.0 111.181 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.85 -41.13 71.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.235 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.477 HD23 ' HB3' ' A' ' 11' ' ' ALA . 78.2 mt -67.39 -34.34 77.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.717 0.294 . . . . 0.0 111.091 178.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.2 mt -69.49 -32.49 71.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.545 175.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.8 m -67.75 -43.95 78.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.426 ' C ' ' HG ' ' A' ' 8' ' ' LEU . . . -63.31 -39.27 94.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.351 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.553 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . . . -62.03 -44.53 96.5 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.158 0.504 . . . . 0.0 110.42 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 5.7 tp10 -67.29 -39.5 85.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.01 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -66.28 -41.02 90.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.216 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' HD22 ' A' ' 8' ' ' LEU . . . -62.25 -36.73 82.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.317 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' OD1' ' HD3' ' A' ' 5' ' ' ARG . 4.5 m-20 -60.87 -41.88 96.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.734 176.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 38.0 mt-10 -70.38 -33.48 71.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.375 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.85 -14.23 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.738 0.304 . . . . 0.0 111.255 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.436 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.385 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -61.48 -44.36 22.92 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.038 2.492 . . . . 0.0 114.227 -173.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.82 -45.11 75.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.025 0.441 . . . . 0.0 110.461 -177.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.78 -34.96 76.44 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.516 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.472 ' O ' HD21 ' A' ' 9' ' ' LEU . 35.6 ttp180 -62.53 -47.75 82.52 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.994 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.85 95.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.137 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -68.97 -45.28 71.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.563 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.495 HD21 ' CB ' ' A' ' 30' ' ' ALA . 58.9 mt -70.63 -41.67 71.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.472 HD21 ' O ' ' A' ' 5' ' ' ARG . 4.2 mm? -63.0 -42.55 99.88 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-O 120.769 0.319 . . . . 0.0 111.03 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.9 p -70.1 -35.17 73.96 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.189 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.477 ' CB ' HD23 ' A' ' 27' ' ' LEU . . . -62.45 -38.94 91.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.246 177.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -43.85 98.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.281 0.562 . . . . 0.0 109.502 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 13.9 mm-40 -68.02 -40.8 82.85 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.372 179.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.479 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 96.5 mttt -67.81 -37.63 82.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.412 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.1 -35.15 79.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.138 0.495 . . . . 0.0 109.945 176.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.411 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 16.3 t70 -63.76 -44.65 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.374 175.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 96.3 mt-10 -65.75 -28.77 69.28 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.333 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 47.7 mt -82.84 -11.78 57.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.855 0.36 . . . . 0.0 111.086 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.36 50.38 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.363 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.5 m -116.28 89.07 25.03 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.59 -37.13 38.93 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.703 2.269 . . . . 0.0 112.73 -177.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -64.57 -43.88 92.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.568 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -73.59 -34.64 65.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.311 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -60.02 -43.91 94.96 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.423 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.887 0.375 . . . . 0.0 110.836 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.83 -40.13 94.69 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.338 0.589 . . . . 0.0 110.308 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.477 HD23 ' CB ' ' A' ' 11' ' ' ALA . 45.0 mt -74.7 -34.64 62.67 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.198 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.3 mt -65.27 -42.4 93.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.301 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 p -64.22 -36.1 82.98 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.25 0.548 . . . . 0.0 109.941 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.495 ' CB ' HD21 ' A' ' 8' ' ' LEU . . . -69.3 -40.41 77.71 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.315 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.73 97.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.727 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -66.34 -40.03 89.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.892 -178.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -73.11 -35.11 66.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.06 89.69 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.834 0.35 . . . . 0.0 110.971 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -63.21 -47.51 82.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.801 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.0 -21.18 61.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.949 0.404 . . . . 0.0 111.112 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.26 -15.69 59.96 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.279 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.578 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.721 179.277 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 120.948 0.404 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -57.39 -34.62 98.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.945 2.43 . . . . 0.0 112.83 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.15 -44.01 93.45 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.862 0.363 . . . . 0.0 110.853 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -72.27 -35.68 68.81 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.441 ' HA ' ' CB ' ' A' ' 34' ' ' ALA . 56.3 ttp180 -62.38 -46.18 89.8 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.897 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.01 97.85 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.91 0.386 . . . . 0.0 110.892 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -67.59 -46.08 73.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.282 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.48 HD21 ' HB2' ' A' ' 30' ' ' ALA . 65.8 mt -72.26 -40.41 67.68 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.53 -41.92 88.01 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.411 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 15.6 p -64.11 -38.12 89.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.371 . . . . 0.0 110.297 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -64.23 -38.67 91.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.168 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.13 -42.67 99.47 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.935 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.82 -41.35 91.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.569 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 10' ' ' THR . 97.5 mttt -63.85 -44.43 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.68 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.36 -43.52 85.79 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.948 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.405 ' OD1' ' HD2' ' A' ' 24' ' ' ARG . 17.9 t70 -59.17 -42.99 92.09 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.019 0.438 . . . . 0.0 110.963 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.97 -35.07 77.4 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.523 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.2 tp -93.31 -17.0 24.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.95 0.405 . . . . 0.0 111.551 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.19 -99.91 1.57 Allowed Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.0 m 42.21 79.68 0.32 Allowed Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 123.543 0.737 . . . . 0.0 111.801 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.56 -43.87 53.94 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 122.736 2.291 . . . . 0.0 113.896 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -74.11 -43.45 57.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.88 0.372 . . . . 0.0 111.633 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.24 -43.24 74.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.502 -177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.405 ' HD2' ' OD1' ' A' ' 16' ' ' ASP . 9.5 ttp180 -62.18 -44.37 96.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.635 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.91 96.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.574 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -73.18 -38.89 65.99 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.941 -178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.471 HD21 ' CB ' ' A' ' 11' ' ' ALA . 70.7 mt -70.73 -38.32 73.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.702 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.08 -39.63 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.664 0.269 . . . . 0.0 111.36 178.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -71.0 -33.22 70.19 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.865 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.48 ' HB2' HD21 ' A' ' 8' ' ' LEU . . . -64.19 -36.04 82.78 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.372 176.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.22 96.02 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.847 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -71.97 -40.33 68.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.899 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.553 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 69.1 mmtt -66.91 -36.45 82.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.545 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.444 ' HB2' HD11 ' A' ' 8' ' ' LEU . . . -63.21 -41.6 99.17 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.155 0.502 . . . . 0.0 110.387 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.56 -38.12 83.67 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.553 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.44 -33.62 74.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.491 177.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 95.6 mt -76.68 -15.48 59.78 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.126 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.004 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.787 -179.804 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.445 -0.713 0 CA-C-O 120.68 0.276 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.18 -40.67 31.7 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.968 2.445 . . . . 0.0 113.493 -177.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 13.8 tp10 -64.3 -44.89 90.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.14 0.495 . . . . 0.0 109.888 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -65.96 -41.78 90.79 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.25 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.9 ttm105 -61.87 -46.86 87.6 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.409 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.62 93.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 79.4 mm-40 -70.04 -44.8 68.47 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.491 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.5 mt -71.21 -37.12 72.1 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.5 tp -69.28 -42.93 74.84 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 120.587 0.232 . . . . 0.0 111.387 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -64.98 -32.83 74.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.705 0.288 . . . . 0.0 110.89 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.419 ' CB ' HD21 ' A' ' 27' ' ' LEU . . . -63.92 -42.62 97.33 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.164 0.506 . . . . 0.0 109.642 176.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.13 -44.21 97.13 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.385 177.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -66.4 -41.09 89.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -65.37 -44.34 87.9 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.08 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.02 85.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -59.57 -37.54 78.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.116 0.484 . . . . 0.0 111.075 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -61.35 -34.71 75.74 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.856 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -93.33 -0.53 56.62 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.707 0.765 . . . . 0.0 110.163 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.84 -101.19 2.68 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.7 m 38.47 70.75 1.22 Allowed Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 123.594 0.758 . . . . 0.0 111.615 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -55.66 -42.92 62.7 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.578 2.185 . . . . 0.0 113.579 -174.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -72.24 -38.2 68.98 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.457 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -72.39 -43.54 63.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.369 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -64.31 -36.59 84.61 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.117 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.71 -44.42 96.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 111.267 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.51 -39.35 74.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.662 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD21 ' CB ' ' A' ' 11' ' ' ALA . 64.8 mt -67.84 -39.54 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.063 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 26.5 mt -64.4 -36.99 85.94 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.834 177.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.633 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 87.6 m -63.57 -41.96 98.35 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 176.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.491 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.68 -36.07 81.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.384 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.95 95.88 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.9 176.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 36.8 mt-10 -70.55 -40.27 73.49 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.63 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 29' ' ' THR . 30.4 mmmt -64.11 -42.73 96.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.925 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.47 ' HB1' HD13 ' A' ' 8' ' ' LEU . . . -60.62 -35.88 77.24 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.817 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.42 -38.41 84.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.585 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.19 -26.6 67.48 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.19 0.519 . . . . 0.0 110.615 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 70.8 mt -77.3 -14.54 59.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.34 177.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.631 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 48.1 Cg_exo -57.71 -44.03 44.78 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.185 2.59 . . . . 0.0 113.543 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 7' ' ' GLN . 44.4 mt-10 -61.52 -45.22 95.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.001 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.94 -33.66 64.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.804 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -62.58 -44.39 96.43 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.51 98.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.835 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 3' ' ' GLU . 92.0 mt-30 -68.84 -46.48 68.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.0 111.015 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.619 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.3 mt -71.78 -39.62 69.82 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 58.3 tp -67.61 -41.92 83.21 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 120.534 0.207 . . . . 0.0 111.223 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.9 p -67.73 -33.08 74.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.078 0.466 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.478 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -66.23 -38.46 87.95 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.935 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -42.91 99.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.242 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 49.2 mt-10 -64.83 -41.51 95.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -66.47 -36.4 82.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.516 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.41 -38.39 86.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.079 0.466 . . . . 0.0 110.461 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.28 -44.42 75.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.052 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 52.5 mt-10 -67.53 -34.86 77.94 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.824 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.4 tp -82.81 -17.33 44.43 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.025 0.44 . . . . 0.0 110.46 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.35 32.18 62.7 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.711 176.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.2 m -92.5 105.52 14.68 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 116.86 0.33 . . . . 0.0 110.48 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 30.3 Cg_endo -64.09 -42.07 20.02 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.631 2.22 . . . . 0.0 113.369 -177.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.6 -43.69 75.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.137 0.494 . . . . 0.0 110.454 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.21 -38.79 65.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.823 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 21' ' ' PRO . 13.1 ptm180 -61.18 -38.62 87.16 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.0 96.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.947 0.403 . . . . 0.0 110.898 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -74.6 -40.93 61.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.235 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 15' ' ' ALA . 78.8 mt -72.43 -41.2 66.44 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -176.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.83 -42.09 90.98 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.767 -0.373 . . . . 0.0 111.213 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 p -67.23 -37.45 83.59 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 110.29 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.619 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.44 -39.1 93.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.002 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.57 93.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.675 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.93 -33.51 61.99 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.958 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 55.4 tptt -66.25 -42.3 88.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.721 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.607 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.26 -35.93 78.63 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.488 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.54 -39.86 85.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.167 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -63.07 -33.08 74.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.584 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.7 mt -78.09 -14.88 59.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.673 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.441 -1.017 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.753 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 120.488 0.185 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.539 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.9 Cg_exo -63.92 -37.89 41.48 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.027 2.484 . . . . 0.0 113.387 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.73 -44.76 92.62 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.95 0.405 . . . . 0.0 110.52 -178.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -68.82 -41.44 78.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.28 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -62.27 -46.33 89.28 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.475 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.77 98.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.787 0.327 . . . . 0.0 111.421 -178.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.7 -44.59 66.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.667 HD22 ' HB1' ' A' ' 30' ' ' ALA . 85.2 mt -70.91 -36.4 72.69 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 tp -68.86 -43.97 74.3 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 120.717 0.294 . . . . 0.0 110.94 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.7 p -64.02 -30.43 71.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.934 0.397 . . . . 0.0 110.341 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.559 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -60.91 -36.15 78.52 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.579 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.09 -44.89 96.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.876 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 0.8 OUTLIER -70.68 -37.65 73.66 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.161 177.465 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.616 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 64.7 tttm -64.26 -43.03 96.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.854 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.03 -34.94 77.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.038 0.447 . . . . 0.0 109.974 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -65.43 -44.29 87.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.579 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 53.1 mt-10 -62.44 -33.4 74.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.832 178.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -82.43 -13.5 56.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 74.73 37.16 46.01 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.855 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.6 m -113.1 91.87 19.95 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-O 120.75 0.31 . . . . 0.0 110.328 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 24.3 Cg_exo -64.82 -41.8 17.03 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.017 2.478 . . . . 0.0 113.159 -177.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.29 -43.53 86.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.345 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -37.47 78.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.761 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.49 -42.53 96.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.076 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.42 91.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.018 0.437 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -71.29 -40.14 71.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.559 HD22 ' HB1' ' A' ' 11' ' ' ALA . 67.5 mt -67.63 -33.09 74.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.078 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -64.86 -37.41 87.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.106 0.479 . . . . 0.0 110.404 176.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.0 m -66.75 -39.27 87.86 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.602 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.667 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.35 -38.88 92.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.793 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.87 -43.22 94.84 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.4 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.93 -39.48 69.41 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.254 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.87 -49.85 76.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.785 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.546 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.67 -35.62 78.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -67.64 -39.31 84.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.42 . . . . 0.0 110.484 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -66.25 -32.2 73.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.784 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.09 -14.57 60.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.782 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.539 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.013 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 32.5 Cg_exo -60.45 -44.44 27.49 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.317 2.678 . . . . 0.0 114.256 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.51 -45.69 86.17 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.927 0.394 . . . . 0.0 109.988 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -68.88 -38.33 79.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.572 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -62.19 -45.97 91.02 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.541 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.57 98.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.069 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.19 -47.44 67.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.999 0.428 . . . . 0.0 111.363 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.5 mt -71.83 -37.41 70.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 35.7 tp -69.03 -44.31 72.97 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.376 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 31.4 p -66.15 -32.79 74.45 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.025 0.441 . . . . 0.0 110.324 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.35 96.91 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.635 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -61.04 -40.62 94.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.533 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 47.0 mt-10 -64.89 -39.83 94.14 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.327 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 60.9 tttm -65.94 -35.73 81.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.838 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.549 ' HB2' HD23 ' A' ' 27' ' ' LEU . . . -64.84 -34.68 78.94 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.084 0.469 . . . . 0.0 110.069 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -66.6 -40.81 89.02 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.81 -28.97 70.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.202 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.8 mt -81.52 -16.6 51.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.164 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.71 34.68 42.9 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.936 -0.65 . . . . 0.0 113.168 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.4 p -117.22 91.68 37.61 Favored Pre-proline 0 C--N 1.319 -0.756 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 -43.73 52.53 Favored 'Trans proline' 0 N--CA 1.48 0.715 0 C-N-CA 123.431 2.754 . . . . 0.0 114.848 -175.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 42.2 tt0 -70.44 -44.72 67.26 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.044 -177.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -66.83 -34.63 78.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -62.96 -44.3 96.43 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.977 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.21 99.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.559 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 50.9 mm-40 -68.08 -41.31 82.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.212 0.53 . . . . 0.0 110.301 -179.254 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 15' ' ' ALA . 9.7 tp -72.82 -33.78 66.41 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.642 -179.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.432 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 13.0 mt -67.33 -33.76 75.93 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 120.805 0.336 . . . . 0.0 110.191 175.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.7 m -63.83 -36.71 84.81 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.62 -40.55 95.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.916 175.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.41 -43.71 96.45 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.065 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 43.5 mt-10 -71.89 -33.12 68.08 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.15 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -63.02 -47.4 83.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.519 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.511 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.915 0.388 . . . . 0.0 110.28 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.17 -45.4 93.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.287 176.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -66.35 -32.64 74.15 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.024 178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -13.98 59.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.619 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.513 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.452 0.168 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.44 -36.25 67.21 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.587 2.191 . . . . 0.0 111.522 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -63.44 -44.94 93.1 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.432 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.12 -42.67 62.66 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.196 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -61.62 -46.08 91.33 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.655 -177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.16 95.42 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.832 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -72.76 -45.76 56.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 111.89 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.725 HD22 ' HB1' ' A' ' 30' ' ' ALA . 95.2 mt -71.54 -36.81 71.1 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.4 tp -69.36 -40.92 77.21 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.4 p -66.74 -33.02 74.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.967 0.413 . . . . 0.0 110.209 178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.634 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.73 -37.37 87.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.994 176.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.11 93.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.995 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 41.7 mt-10 -70.09 -41.86 73.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.397 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.575 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 17.1 tppt? -63.84 -36.6 84.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.92 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.34 -39.43 90.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.051 0.453 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.0 -39.28 79.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 64.5 mm-40 -64.79 -22.81 67.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.646 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 87.1 mt -83.55 -16.25 46.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.688 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.65 20.74 79.74 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.889 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.2 t -109.2 103.54 52.72 Favored Pre-proline 0 C--N 1.32 -0.699 0 O-C-N 122.827 -0.22 . . . . 0.0 110.42 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -38.16 45.38 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.71 2.273 . . . . 0.0 113.082 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.12 -45.05 95.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.841 0.353 . . . . 0.0 110.75 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.52 -33.47 62.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.594 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' HD13 ' A' ' 28' ' ' LEU . 59.6 ttp180 -60.13 -45.3 93.49 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.236 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -41.44 93.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.838 0.351 . . . . 0.0 110.94 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -67.77 -43.26 80.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.14 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.735 HD12 ' HB2' ' A' ' 15' ' ' ALA . 51.1 mt -73.01 -33.04 65.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.738 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 24' ' ' ARG . 8.3 mp -66.12 -31.81 72.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 110.253 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 50.2 m -64.71 -44.08 91.37 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.725 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.58 -40.33 96.67 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.755 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.07 -40.5 89.71 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.134 0.492 . . . . 0.0 110.157 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -70.96 -40.97 71.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.466 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 33.8 mmtp -61.49 -41.14 96.82 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.324 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.711 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.44 -39.83 88.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.952 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -66.42 -42.92 87.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.717 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -62.38 -32.43 73.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.779 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 78.4 mt -77.02 -15.44 59.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.71 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.397 -179.089 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 120.447 0.165 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.85 -34.53 81.97 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.889 2.393 . . . . 0.0 111.242 177.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.64 -44.92 95.05 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.91 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -73.92 -37.7 64.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.942 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.445 ' NH2' ' HA ' ' A' ' 35' ' ' ASP . 42.2 ttm-85 -61.93 -47.22 85.9 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.443 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.62 -44.23 97.38 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -71.39 -45.0 63.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 98.4 mt -71.79 -41.2 68.59 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.71 -39.92 76.59 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -176.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.0 p -64.35 -32.02 73.47 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.939 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.11 -37.78 86.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.549 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.15 99.45 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.06 -41.63 77.32 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.833 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 87.7 tttt -64.67 -41.65 95.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.671 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.413 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.36 -34.93 77.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.657 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -68.25 -41.49 81.07 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.102 0.477 . . . . 0.0 110.045 178.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.42 -33.12 74.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.39 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.3 mt -81.85 -9.12 59.7 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.007 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.552 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.96 36.13 72.89 Favored Glycine 0 N--CA 1.441 -0.985 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.844 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.5 m -106.16 92.92 7.2 Favored Pre-proline 0 C--N 1.321 -0.633 0 C-N-CA 122.138 0.175 . . . . 0.0 110.695 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 23.4 Cg_exo -65.3 -42.35 13.57 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.614 2.209 . . . . 0.0 112.48 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -67.46 -44.28 78.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -72.34 -36.94 68.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -64.26 -36.45 84.14 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.453 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.19 92.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.032 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -71.58 -41.81 68.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.595 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.576 HD22 ' HB1' ' A' ' 11' ' ' ALA . 89.1 mt -68.45 -34.31 75.73 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.743 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -67.81 -34.81 77.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.849 0.357 . . . . 0.0 110.643 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.6 m -66.51 -35.61 80.68 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.89 -41.51 95.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.978 176.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.14 80.09 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.231 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 7.0 tp10 -71.64 -40.91 69.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.146 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.4 ttmt -66.06 -35.85 81.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.09 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.567 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.02 -36.86 82.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.721 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.445 ' HA ' ' NH2' ' A' ' 5' ' ' ARG . 25.0 t70 -65.8 -41.21 92.21 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.538 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 36.3 mt-10 -69.03 -25.73 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.302 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 85.0 mt -81.88 -15.36 54.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.811 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.399 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.401 -179.016 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 33.2 Cg_exo -61.06 -44.42 24.47 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.957 2.438 . . . . 0.0 112.883 -177.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -66.43 -44.57 82.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.86 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.24 -33.85 67.84 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.743 0.306 . . . . 0.0 110.562 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -62.36 -46.1 90.19 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.831 178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.85 -42.96 99.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.429 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.47 -44.14 79.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.608 HD22 ' HB1' ' A' ' 30' ' ' ALA . 50.1 mt -70.52 -36.58 73.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.567 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 tp -67.01 -43.71 82.18 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.703 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.7 p -67.95 -32.16 72.41 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.956 0.407 . . . . 0.0 110.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.49 85.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.013 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.41 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -61.71 -39.14 90.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.834 176.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 40.3 tt0 -70.01 -41.29 74.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.26 177.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -63.65 -43.45 96.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.942 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.427 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.7 -35.03 76.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.936 0.398 . . . . 0.0 110.248 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.28 -41.74 80.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.656 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 29.6 mm-40 -62.26 -33.31 74.38 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.964 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -87.76 -0.46 56.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.412 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.12 36.99 94.2 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.529 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.1 m -105.02 95.07 8.57 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.51 -42.32 21.9 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.818 2.345 . . . . 0.0 113.767 -177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -66.66 -44.56 81.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.053 0.454 . . . . 0.0 110.642 -178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -72.03 -35.82 69.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -62.06 -44.18 97.23 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.647 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.41 -43.7 96.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.119 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -42.52 84.38 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.144 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.484 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.2 mt -69.58 -37.92 77.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.534 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.41 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 25.7 mt -64.37 -36.64 84.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 0.0 110.277 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.455 HG22 ' HE3' ' A' ' 33' ' ' LYS . 50.4 m -70.74 -37.79 73.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.6 177.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.608 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.91 -35.96 81.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.61 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.54 94.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.145 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 47.9 mt-10 -72.24 -39.66 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.873 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 29' ' ' THR . 96.8 mttt -63.32 -40.36 97.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.456 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.01 78.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.368 0.604 . . . . 0.0 109.816 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.66 -39.94 95.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.64 178.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 46.2 mt-10 -62.98 -33.98 76.55 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.241 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.97 -13.84 59.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.003 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.536 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.798 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.074 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 13.0 p . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.496 0.188 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 35.9 Cg_endo -64.57 -44.7 10.48 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.897 2.398 . . . . 0.0 113.422 -177.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.73 -41.3 75.49 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 120.804 0.335 . . . . 0.0 111.109 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.39 -40.9 94.02 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -62.98 -40.75 98.69 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.328 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.57 96.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -69.64 -44.7 70.07 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.066 0.46 . . . . 0.0 111.051 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.632 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.8 mt -71.05 -37.78 72.52 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.05 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 11.6 tp -67.43 -44.26 79.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.034 -178.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -64.02 -37.41 87.31 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.333 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.47 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.92 -38.75 92.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.132 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.27 96.9 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.966 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 46.9 mm-40 -64.62 -40.82 96.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.453 178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.642 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -66.45 -45.66 79.03 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.872 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.79 78.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.79 -38.12 88.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.945 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -71.7 -29.2 64.3 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.64 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 72.5 mt -81.33 -16.28 52.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.639 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.51 26.37 61.32 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.546 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.6 t -103.28 104.42 40.84 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.43 -41.86 30.76 Favored 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.888 2.392 . . . . 0.0 113.445 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.27 -44.83 95.64 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.881 0.372 . . . . 0.0 111.478 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -74.79 -38.98 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.581 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.404 ' HG2' HD12 ' A' ' 28' ' ' LEU . 69.0 ttt-85 -60.13 -44.74 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.269 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.12 82.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.965 0.412 . . . . 0.0 111.186 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -65.85 -41.74 91.31 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.76 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.47 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.7 mt -74.17 -37.4 63.99 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.257 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.404 HD12 ' HG2' ' A' ' 24' ' ' ARG . 19.7 mt -64.5 -40.64 96.02 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.403 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.9 p -69.43 -32.58 71.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.01 0.433 . . . . 0.0 110.322 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.632 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -67.18 -40.88 86.65 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.083 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB1' HD12 ' A' ' 9' ' ' LEU . . . -59.91 -42.97 95.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.232 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -71.7 -33.6 68.93 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.432 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 40.7 ttmt -64.05 -49.81 70.88 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.639 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.64 -34.75 76.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.145 0.498 . . . . 0.0 110.339 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.05 -41.17 99.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.081 177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -66.02 -31.78 72.88 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.44 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.1 mt -75.94 -13.55 60.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.376 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.059 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.883 -179.297 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.668 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 26.0 Cg_exo -63.91 -44.36 13.3 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.019 2.479 . . . . 0.0 112.98 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.36 -43.69 92.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.866 0.365 . . . . 0.0 111.219 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.25 -39.35 65.5 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.372 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -61.77 -43.53 98.68 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.9 -42.95 99.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.232 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -70.97 -44.61 65.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.882 0.372 . . . . 0.0 111.38 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.604 HD22 ' HB1' ' A' ' 30' ' ' ALA . 67.4 mt -70.12 -39.05 75.67 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.157 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.87 -40.58 79.19 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.236 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.402 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 13.8 p -67.32 -34.11 76.68 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.362 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.478 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.66 -39.75 94.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.903 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.97 94.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.963 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 34.0 tt0 -70.56 -41.36 72.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.172 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 10' ' ' THR . 2.3 mptm? -63.92 -44.17 93.71 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.565 0.221 . . . . 0.0 111.068 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.8 78.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.969 0.414 . . . . 0.0 109.961 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.35 -45.6 79.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.231 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 50.3 mt-10 -62.08 -34.73 76.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.627 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -82.29 -7.82 59.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.958 0.408 . . . . 0.0 111.483 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.568 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 76.15 32.43 52.46 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.105 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -101.36 95.64 5.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.568 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 21.9 Cg_exo -65.23 -42.6 13.08 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.87 2.38 . . . . 0.0 113.282 -176.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -69.58 -44.16 71.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.772 0.32 . . . . 0.0 110.868 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.3 -38.95 88.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.223 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -60.57 -45.17 94.93 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.14 94.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.788 0.328 . . . . 0.0 111.267 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -67.79 -40.84 83.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.478 HD22 ' CB ' ' A' ' 11' ' ' ALA . 65.4 mt -70.02 -35.57 74.45 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.145 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.5 mt -66.53 -32.01 73.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.329 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -62.79 -40.89 98.74 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.604 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -70.78 -38.66 73.41 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.228 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.12 94.13 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.689 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -72.83 -37.45 67.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.734 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -68.7 -48.6 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.748 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.19 -34.6 72.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.559 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.83 -42.4 98.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.336 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -63.78 -35.75 81.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.582 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.46 -14.66 59.64 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 120.992 0.425 . . . . 0.0 110.867 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.668 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.433 -1.541 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.652 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.441 0.162 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.541 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.6 Cg_exo -63.86 -44.08 14.28 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.024 2.483 . . . . 0.0 113.488 -177.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.45 -44.5 90.92 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.867 0.365 . . . . 0.0 110.611 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -66.14 -35.67 81.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.037 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.9 -43.86 97.64 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.445 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.05 -42.65 98.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.947 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -69.78 -44.01 70.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 111.441 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 30' ' ' ALA . 86.6 mt -70.44 -39.14 74.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.1 tp -69.1 -41.11 77.9 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.741 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.5 p -64.46 -32.82 74.61 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.596 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.477 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.51 -38.05 89.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.175 176.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -44.3 96.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.828 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -66.63 -39.68 88.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.286 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -68.07 -33.65 74.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.284 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.938 0.399 . . . . 0.0 110.362 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.16 -41.91 85.21 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.6 -34.72 76.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.509 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.63 -17.48 41.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.931 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.89 33.38 65.95 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.072 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 21' ' ' PRO . 4.5 p -105.87 101.25 32.24 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.958 0.379 . . . . 0.0 110.699 179.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 20' ' ' CYS . 30.7 Cg_endo -62.19 -39.99 44.6 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.069 2.513 . . . . 0.0 114.346 -175.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.37 -43.25 86.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.125 0.488 . . . . 0.0 110.624 -177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.52 -38.75 62.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.324 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -59.62 -44.66 93.36 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.02 -178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.65 93.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.008 -179.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -68.82 -42.26 77.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.976 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.477 HD22 ' CB ' ' A' ' 11' ' ' ALA . 66.6 mt -67.1 -34.42 77.59 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.541 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 19.9 mt -67.01 -39.41 87.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.334 176.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.2 m -65.52 -35.17 80.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.069 0.461 . . . . 0.0 109.836 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.16 -39.07 93.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.196 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.92 97.94 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.212 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 37.4 mt-10 -71.95 -39.81 69.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.035 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 88.6 tttt -65.12 -40.54 94.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.13 -35.18 74.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.568 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.13 -44.51 91.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.168 176.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.64 -29.49 69.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.148 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 68.1 mt -78.92 -14.57 59.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.681 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.541 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.446 -0.664 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.294 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.554 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 16.6 m . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.18 -44.22 12.83 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.918 2.412 . . . . 0.0 113.679 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 37.7 tt0 -65.88 -43.79 87.3 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.892 -177.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.554 ' OE1' ' HB3' ' A' ' 1' ' ' SER . 20.0 mp0 -65.19 -39.5 92.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 58.0 ttp180 -62.03 -45.2 94.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.82 99.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.665 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 71.1 mm-40 -63.81 -43.15 97.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.059 0.456 . . . . 0.0 110.74 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.599 HD22 ' HB1' ' A' ' 30' ' ' ALA . 45.7 mt -70.5 -40.38 73.59 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.372 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -68.7 -40.08 80.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.472 -178.508 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 6.2 p -64.41 -37.35 87.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.861 0.362 . . . . 0.0 110.114 177.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.504 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.83 -36.97 84.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.425 177.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.32 -40.75 91.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.567 177.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -68.79 -41.26 78.97 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.394 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.606 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 29.2 mtpp -64.22 -44.69 91.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.323 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.9 -37.12 86.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.993 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.57 -44.2 78.76 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.959 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.15 -31.78 72.3 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.522 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 54.3 mt -82.76 -9.34 59.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.22 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.71 39.69 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.755 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 m -114.48 92.04 26.82 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.784 0.326 . . . . 0.0 110.743 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.84 -42.19 15.77 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.118 2.545 . . . . 0.0 113.118 -177.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 11.3 mp0 -62.43 -43.79 97.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.728 0.299 . . . . 0.0 110.678 -178.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.89 -39.54 79.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.042 0.449 . . . . 0.0 110.138 178.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -60.07 -43.6 95.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.665 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.12 88.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.408 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 58.6 mm-40 -72.12 -37.09 69.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.09 0.472 . . . . 0.0 110.899 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.504 HD22 ' CB ' ' A' ' 11' ' ' ALA . 43.8 mt -73.27 -36.21 66.31 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.072 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 32.3 mt -67.21 -39.5 86.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.206 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.2 p -70.98 -32.82 69.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.153 0.502 . . . . 0.0 110.388 178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.599 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.19 -40.43 97.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.287 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -40.57 88.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.409 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.65 -39.79 80.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.244 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -68.43 -40.88 81.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.655 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.84 -35.26 79.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.476 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.44 -36.97 84.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.312 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.53 -33.05 74.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.158 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.9 -14.29 59.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.818 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.022 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.617 -178.232 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 CA--C 1.54 0.573 0 CA-C-O 120.591 0.234 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.3 Cg_exo -63.82 -45.33 11.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.148 2.565 . . . . 0.0 113.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.27 -44.22 88.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.467 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -66.29 -39.71 89.55 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.962 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -64.33 -39.51 94.05 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.146 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.71 -42.59 93.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.827 0.346 . . . . 0.0 111.322 -177.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -69.57 -44.13 71.47 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.694 HD22 ' HB1' ' A' ' 30' ' ' ALA . 88.8 mt -70.4 -37.7 74.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.281 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.3 tp -68.9 -39.71 79.55 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -67.48 -32.49 73.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.919 0.39 . . . . 0.0 110.303 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.81 -40.42 97.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.87 175.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.857 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -64.72 -41.21 96.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.161 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.401 ' O ' HD23 ' A' ' 18' ' ' LEU . 84.5 tttt -64.51 -45.82 85.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.994 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -65.99 -34.96 79.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -68.39 -38.95 81.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.01 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -66.95 -35.26 79.57 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.83 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.401 HD23 ' O ' ' A' ' 14' ' ' LYS . 4.1 mm? -81.03 -11.76 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.3 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.74 24.84 73.49 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.919 178.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.6 t -95.27 101.98 8.66 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.14 -43.0 12.23 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.806 2.337 . . . . 0.0 114.532 -173.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -71.36 -43.3 67.19 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.442 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.74 -35.06 78.06 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.277 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HG2' HD12 ' A' ' 28' ' ' LEU . 57.5 ttp180 -61.54 -43.97 97.9 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.122 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -43.62 98.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.776 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -65.92 -43.02 89.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.775 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 11' ' ' ALA . 83.5 mt -73.28 -35.85 66.22 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.844 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.453 HD12 ' HG2' ' A' ' 24' ' ' ARG . 15.5 mt -67.58 -33.61 75.37 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.755 0.312 . . . . 0.0 110.511 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.9 m -63.82 -40.83 97.55 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.694 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -66.67 -39.84 88.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.628 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -43.82 95.35 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.246 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 64.5 mm-40 -73.09 -39.68 65.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.156 177.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.627 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.7 tptt -54.54 -55.69 26.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.953 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.87 -34.55 74.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.099 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.02 -42.33 97.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.113 177.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 57.5 mm-40 -65.67 -34.17 77.59 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.319 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 73.3 mt -76.67 -14.8 59.94 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.583 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.489 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.445 -0.728 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.59 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.739 0.304 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -63.94 -34.84 58.22 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.057 2.505 . . . . 0.0 112.09 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.08 -44.38 89.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.182 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -70.53 -33.9 71.68 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.66 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -62.37 -42.06 99.1 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.706 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.44 -42.92 99.5 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.923 0.392 . . . . 0.0 110.867 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.75 -40.6 88.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.211 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.546 HD22 ' HB1' ' A' ' 30' ' ' ALA . 53.1 mt -69.83 -37.94 76.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.445 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -65.39 -41.22 93.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.243 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -72.0 -32.18 66.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.939 0.4 . . . . 0.0 110.229 177.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.496 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.38 -37.76 86.98 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.436 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -60.76 -43.82 97.53 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.726 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.91 -33.88 72.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.339 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -65.13 -46.11 82.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.869 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.79 -36.32 83.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.957 0.408 . . . . 0.0 110.799 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.14 -41.24 94.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.863 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.09 -34.49 78.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.866 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.09 -11.84 58.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.03 34.79 29.24 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.046 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.1 m -111.19 90.82 12.2 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.04 -42.04 15.25 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.788 2.325 . . . . 0.0 113.353 -176.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.7 -43.14 80.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.607 0.241 . . . . 0.0 110.795 -177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.72 -38.62 87.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.51 -44.88 95.56 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.673 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.87 90.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.268 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -69.28 -40.94 77.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.496 HD22 ' HB1' ' A' ' 11' ' ' ALA . 61.8 mt -68.58 -33.52 74.2 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.155 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.434 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 44.5 mt -66.32 -42.98 87.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.22 177.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.3 p -65.69 -31.78 72.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.86 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.9 -34.38 77.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.9 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.67 92.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.857 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.6 -40.29 66.64 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.972 0.415 . . . . 0.0 111.019 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.604 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 61.3 mmtt -65.12 -35.04 79.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.919 -178.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.24 -35.57 79.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.686 0.279 . . . . 0.0 110.901 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -67.65 -42.49 82.15 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.02 -33.36 75.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.678 177.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.6 mt -76.92 -14.46 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.87 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.47 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.542 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 25.7 Cg_exo -63.09 -41.96 25.7 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.081 2.52 . . . . 0.0 113.556 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.72 -46.15 69.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.767 0.318 . . . . 0.0 111.15 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.8 -34.0 73.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.542 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.55 ' HG2' HD12 ' A' ' 9' ' ' LEU . 43.7 ttt180 -62.72 -45.33 93.23 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.739 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.68 -42.21 98.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.798 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -63.38 -44.48 94.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.852 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.547 HD22 ' HB1' ' A' ' 30' ' ' ALA . 55.8 mt -70.03 -40.6 75.07 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.614 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.55 HD12 ' HG2' ' A' ' 5' ' ' ARG . 13.6 mt -67.08 -36.08 81.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.984 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 14.2 p -71.99 -36.77 69.85 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.94 177.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.54 -37.35 85.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.164 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -60.71 -42.32 97.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.724 176.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -69.75 -41.07 75.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.286 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 32.4 mmtp -66.24 -40.55 90.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.597 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.07 -35.09 79.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.409 . . . . 0.0 110.384 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.85 -40.77 88.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.888 177.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -65.12 -28.39 69.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.325 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 85.0 mt -82.24 -11.18 58.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.718 178.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.76 50.08 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.724 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -114.54 91.84 26.34 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.33 -39.82 27.91 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.843 2.362 . . . . 0.0 112.802 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 33.0 tt0 -67.12 -43.17 83.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.723 0.297 . . . . 0.0 110.505 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -64.49 -42.2 96.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 56.3 ttt180 -60.73 -43.03 98.41 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.461 178.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.95 97.59 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.063 0.459 . . . . 0.0 111.155 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 90.6 mt-30 -65.73 -41.14 92.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.487 HD22 ' CB ' ' A' ' 11' ' ' ALA . 37.6 mt -73.54 -36.18 65.64 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.739 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.3 mt -66.73 -37.48 84.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.416 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -70.94 -31.85 68.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.158 0.504 . . . . 0.0 110.082 177.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.547 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.61 -35.2 80.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.21 82.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.72 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -69.49 -40.38 77.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.892 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -61.69 -49.23 77.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.837 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.455 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.12 -35.27 80.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.407 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.17 -46.67 87.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.514 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.91 -27.13 67.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.14 0.495 . . . . 0.0 110.321 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -76.77 -14.65 59.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.896 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.542 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.617 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.909 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.77 -42.34 20.52 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.888 2.392 . . . . 0.0 113.892 -175.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -67.66 -46.11 73.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.021 0.439 . . . . 0.0 111.264 -177.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.13 -32.83 71.01 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.819 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.48 ' HG2' HD12 ' A' ' 9' ' ' LEU . 63.9 ttt-85 -61.5 -46.2 91.01 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.955 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.6 -43.24 94.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.59 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -66.35 -42.83 87.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.687 0.28 . . . . 0.0 111.682 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.523 HD22 ' HB1' ' A' ' 30' ' ' ALA . 68.5 mt -69.63 -38.31 77.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.727 0.298 . . . . 0.0 111.514 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.544 ' HG ' ' HB1' ' A' ' 31' ' ' ALA . 11.6 mt -67.45 -38.85 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.867 178.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -72.0 -32.81 67.55 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.577 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.485 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.39 -37.33 85.31 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.827 176.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.496 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.86 -44.55 96.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.285 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.12 -40.61 71.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.109 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.34 -37.2 86.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.537 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -37.98 88.63 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.479 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.61 -41.6 96.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.78 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.22 -34.79 75.69 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.612 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.3 tp -90.06 0.14 57.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.284 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.64 -92.99 1.51 Allowed Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -177.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' GLU . 36.1 m 25.32 70.18 0.39 Allowed Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.116 1.366 . . . . 0.0 113.769 175.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.3 -41.86 46.82 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.407 2.071 . . . . 0.0 112.78 -177.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.24 -44.23 63.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.917 0.389 . . . . 0.0 111.283 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 20' ' ' CYS . 31.5 mt-10 -66.08 -34.86 79.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.152 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 67.3 ttt180 -61.03 -43.47 98.84 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.184 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.25 95.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.566 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.29 -41.9 99.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.658 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.485 HD22 ' CB ' ' A' ' 11' ' ' ALA . 48.2 mt -68.92 -38.35 79.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.055 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.496 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 37.1 mt -65.69 -32.51 74.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 176.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.0 m -68.04 -40.28 82.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.731 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.523 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.18 -35.76 81.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.685 177.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HG ' ' A' ' 9' ' ' LEU . . . -59.27 -43.27 92.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.861 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -72.69 -39.45 67.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 ttmt -63.12 -45.64 91.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.897 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.04 -34.94 79.62 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.049 0.452 . . . . 0.0 110.225 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.28 -43.72 97.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.409 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.99 -30.53 71.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.971 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.3 mt -76.91 -13.41 59.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.991 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.007 0 C-N-CA 120.688 -0.767 . . . . 0.0 111.823 -178.561 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -58.84 -44.31 36.85 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.133 2.555 . . . . 0.0 113.638 -177.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -64.59 -42.93 95.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.842 0.354 . . . . 0.0 111.41 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -73.38 -34.3 65.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.274 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -62.34 -45.1 94.73 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.992 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.77 99.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.274 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -68.66 -44.88 73.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.923 -179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.645 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.7 mt -70.52 -36.42 73.73 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.916 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.1 tp -68.85 -40.79 79.15 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.944 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.5 p -68.19 -32.8 73.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.122 0.487 . . . . 0.0 110.043 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.525 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.63 -37.23 85.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.86 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.91 94.09 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.545 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 31.2 mt-10 -70.25 -34.45 72.85 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.079 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.476 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 55.2 mttp -63.5 -44.8 93.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.593 0.235 . . . . 0.0 110.915 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.55 78.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.123 0.487 . . . . 0.0 109.798 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -64.03 -42.65 97.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.574 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 24.2 mm-40 -62.01 -34.32 75.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.836 177.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -81.55 -15.97 53.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.798 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.37 33.31 48.95 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.793 179.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -113.82 97.79 45.57 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.046 0.451 . . . . 0.0 110.944 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.14 -37.04 86.49 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 123.123 2.549 . . . . 0.0 113.341 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.54 -46.0 90.38 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.779 0.323 . . . . 0.0 111.204 -176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -76.43 -35.3 58.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.862 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -60.75 -43.25 98.21 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.322 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.71 95.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.651 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -65.37 -42.89 92.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.525 HD22 ' HB1' ' A' ' 11' ' ' ALA . 60.2 mt -71.38 -35.78 71.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.654 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.1 mt -66.16 -34.4 77.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.922 0.391 . . . . 0.0 110.414 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.5 m -64.78 -36.84 85.61 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.419 0.628 . . . . 0.0 109.361 176.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.645 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -69.45 -38.68 77.91 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.641 178.055 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.49 93.75 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.903 177.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -70.75 -40.48 72.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.625 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -64.72 -43.19 94.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.015 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.62 -35.14 79.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.457 . . . . 0.0 110.434 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.06 -42.87 84.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.258 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -63.47 -35.4 80.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.036 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 37' ' ' LEU . 1.9 tm? -77.1 -14.89 59.74 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.221 0.534 . . . . 0.0 110.13 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.824 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.92 -179.474 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 110.555 -0.165 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.1 Cg_exo -64.14 -45.07 10.74 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.797 2.332 . . . . 0.0 113.019 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 59.2 mm-40 -68.22 -42.94 79.04 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.709 0.29 . . . . 0.0 111.145 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -66.01 -39.68 90.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.426 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -62.24 -43.49 98.71 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.323 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.87 -42.91 98.83 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.121 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.8 mm100 -70.01 -44.39 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.939 0.399 . . . . 0.0 111.379 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.62 HD22 ' HB1' ' A' ' 30' ' ' ALA . 79.2 mt -71.09 -38.31 72.41 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.34 -178.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.38 -44.01 79.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 120.644 0.259 . . . . 0.0 111.066 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.8 p -67.15 -32.66 73.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.5 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.41 -37.41 85.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.248 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.466 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.56 -39.22 87.18 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.791 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.54 -39.68 73.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.269 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -64.61 -45.14 88.17 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.912 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.78 -36.32 80.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.924 0.393 . . . . 0.0 110.814 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.81 -44.76 84.71 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.192 0.52 . . . . 0.0 109.615 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.22 -31.68 72.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.056 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 95.3 mt -82.46 -16.01 50.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.518 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.98 29.86 27.48 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.227 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.5 m -102.72 97.84 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.77 -43.86 9.03 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.36 2.04 . . . . 0.0 113.435 -176.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.52 -42.92 64.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.029 0.442 . . . . 0.0 110.594 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.78 -34.26 77.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.017 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -59.91 -44.73 94.12 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -39.26 77.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.941 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -63.26 -42.49 99.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.095 0.474 . . . . 0.0 110.556 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.515 HD12 ' HB2' ' A' ' 15' ' ' ALA . 57.6 mt -75.3 -35.84 61.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.922 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 18.5 mt -64.18 -39.35 93.8 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 p -70.96 -34.63 71.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.944 0.402 . . . . 0.0 110.075 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.62 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.76 -35.82 81.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.447 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.95 90.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.76 177.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -71.66 -40.12 69.86 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.905 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 65.2 mttm -57.19 -54.8 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.426 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.83 -35.89 79.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.89 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.05 -42.36 89.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.405 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.94 -33.59 76.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.169 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.8 mt -79.41 -14.45 58.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.386 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.571 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.781 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.207 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 68.6 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 30.7 Cg_endo -63.36 -38.38 43.75 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.97 2.447 . . . . 0.0 112.787 -177.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -69.45 -44.04 72.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 0.0 110.282 -178.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -66.63 -36.68 83.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.805 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.494 ' HD3' ' OD1' ' A' ' 35' ' ' ASP . 8.8 ttm180 -61.68 -46.44 89.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.642 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.92 -39.91 91.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.19 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.86 -45.75 84.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.723 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.734 HD23 ' HB2' ' A' ' 34' ' ' ALA . 0.5 OUTLIER -71.66 -43.77 65.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.472 HD13 ' HG2' ' A' ' 5' ' ' ARG . 10.5 mp -62.35 -37.85 87.27 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.412 -178.291 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 21.9 p -72.09 -32.45 67.03 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.274 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.63 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.46 85.75 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.612 177.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.85 97.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.603 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.17 -37.2 78.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.395 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 68.5 mttm -64.75 -36.44 84.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.634 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -66.22 -35.38 80.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.984 177.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.29 -43.14 99.37 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.809 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -67.25 -34.76 78.14 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.756 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 76.8 mt -81.88 -17.59 46.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.096 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.403 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.84 28.82 71.5 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 113.016 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 23' ' ' GLU . 4.0 p -105.14 102.17 34.77 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.906 0.384 . . . . 0.0 111.168 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 43.0 Cg_exo -57.78 -41.71 67.03 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.264 2.643 . . . . 0.0 113.62 -177.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.86 -44.81 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.334 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 34.7 mt-10 -69.63 -36.13 75.85 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.975 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -60.97 -44.37 97.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.77 97.9 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.87 0.367 . . . . 0.0 111.181 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.85 -41.13 71.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.235 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.63 HD22 ' HB1' ' A' ' 11' ' ' ALA . 78.2 mt -67.39 -34.34 77.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.717 0.294 . . . . 0.0 111.091 178.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.2 mt -69.49 -32.49 71.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.545 175.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.8 m -67.75 -43.95 78.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.506 ' HB1' ' HG ' ' A' ' 8' ' ' LEU . . . -63.31 -39.27 94.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.351 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.593 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . . . -62.03 -44.53 96.5 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.158 0.504 . . . . 0.0 110.42 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 5.7 tp10 -67.29 -39.5 85.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.01 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -66.28 -41.02 90.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.216 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.734 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -62.25 -36.73 82.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.317 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' OD1' ' HD3' ' A' ' 5' ' ' ARG . 4.5 m-20 -60.87 -41.88 96.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.734 176.081 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 38.0 mt-10 -70.38 -33.48 71.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.375 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.85 -14.23 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.738 0.304 . . . . 0.0 111.255 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.436 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.385 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -61.48 -44.36 22.92 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.038 2.492 . . . . 0.0 114.227 -173.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.82 -45.11 75.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.025 0.441 . . . . 0.0 110.461 -177.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.78 -34.96 76.44 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.516 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.515 ' O ' HD23 ' A' ' 9' ' ' LEU . 35.6 ttp180 -62.53 -47.75 82.52 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.994 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.85 95.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.137 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -68.97 -45.28 71.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.563 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 30' ' ' ALA . 58.9 mt -70.63 -41.67 71.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 5' ' ' ARG . 4.2 mm? -63.0 -42.55 99.88 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-O 120.769 0.319 . . . . 0.0 111.03 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.9 p -70.1 -35.17 73.96 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.189 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.466 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.45 -38.94 91.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.246 177.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -43.85 98.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.281 0.562 . . . . 0.0 109.502 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 13.9 mm-40 -68.02 -40.8 82.85 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.372 179.273 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 96.5 mttt -67.81 -37.63 82.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.412 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.1 -35.15 79.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.138 0.495 . . . . 0.0 109.945 176.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.42 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 16.3 t70 -63.76 -44.65 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.374 175.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 96.3 mt-10 -65.75 -28.77 69.28 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.333 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 47.7 mt -82.84 -11.78 57.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.855 0.36 . . . . 0.0 111.086 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.36 50.38 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.363 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.5 m -116.28 89.07 25.03 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.59 -37.13 38.93 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.703 2.269 . . . . 0.0 112.73 -177.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -64.57 -43.88 92.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.568 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -73.59 -34.64 65.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.311 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -60.02 -43.91 94.96 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.423 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.887 0.375 . . . . 0.0 110.836 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.83 -40.13 94.69 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.338 0.589 . . . . 0.0 110.308 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.466 HD22 ' CB ' ' A' ' 11' ' ' ALA . 45.0 mt -74.7 -34.64 62.67 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.198 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.3 mt -65.27 -42.4 93.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.301 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 p -64.22 -36.1 82.98 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.25 0.548 . . . . 0.0 109.941 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.489 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -69.3 -40.41 77.71 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.315 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 9' ' ' LEU . . . -60.59 -43.73 97.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.727 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -66.34 -40.03 89.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.892 -178.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -73.11 -35.11 66.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.483 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -64.42 -38.06 89.69 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.834 0.35 . . . . 0.0 110.971 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -63.21 -47.51 82.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.801 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.0 -21.18 61.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.949 0.404 . . . . 0.0 111.112 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.26 -15.69 59.96 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.279 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.578 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.721 179.277 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 120.948 0.404 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -57.39 -34.62 98.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.945 2.43 . . . . 0.0 112.83 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.15 -44.01 93.45 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.862 0.363 . . . . 0.0 110.853 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -72.27 -35.68 68.81 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.439 ' HA ' ' CB ' ' A' ' 34' ' ' ALA . 56.3 ttp180 -62.38 -46.18 89.8 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.897 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.01 97.85 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.91 0.386 . . . . 0.0 110.892 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -67.59 -46.08 73.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.282 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.666 HD12 ' HB2' ' A' ' 34' ' ' ALA . 65.8 mt -72.26 -40.41 67.68 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.53 -41.92 88.01 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 15.6 p -64.11 -38.12 89.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.371 . . . . 0.0 110.297 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.439 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.23 -38.67 91.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.168 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.475 ' HB1' HD23 ' A' ' 28' ' ' LEU . . . -62.13 -42.67 99.47 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.935 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.82 -41.35 91.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.569 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 10' ' ' THR . 97.5 mttt -63.85 -44.43 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.68 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.36 -43.52 85.79 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.948 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' HD2' ' A' ' 24' ' ' ARG . 17.9 t70 -59.17 -42.99 92.09 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.019 0.438 . . . . 0.0 110.963 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.97 -35.07 77.4 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.523 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.2 tp -93.31 -17.0 24.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.95 0.405 . . . . 0.0 111.551 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.19 -99.91 1.57 Allowed Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.0 m 42.21 79.68 0.32 Allowed Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 123.543 0.737 . . . . 0.0 111.801 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.56 -43.87 53.94 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 122.736 2.291 . . . . 0.0 113.896 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -74.11 -43.45 57.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.88 0.372 . . . . 0.0 111.633 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.24 -43.24 74.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.502 -177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.417 ' HD2' ' OD1' ' A' ' 16' ' ' ASP . 9.5 ttp180 -62.18 -44.37 96.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.635 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.91 96.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.574 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -73.18 -38.89 65.99 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.941 -178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.439 HD22 ' CB ' ' A' ' 11' ' ' ALA . 70.7 mt -70.73 -38.32 73.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.702 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.475 HD23 ' HB1' ' A' ' 12' ' ' ALA . 29.0 mt -67.08 -39.63 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.664 0.269 . . . . 0.0 111.36 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -71.0 -33.22 70.19 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.865 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.19 -36.04 82.78 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.372 176.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.22 96.02 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.847 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -71.97 -40.33 68.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.899 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 69.1 mmtt -66.91 -36.45 82.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.545 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.21 -41.6 99.17 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.155 0.502 . . . . 0.0 110.387 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.56 -38.12 83.67 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.553 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.44 -33.62 74.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.491 177.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 95.6 mt -76.68 -15.48 59.78 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.126 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.004 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.787 -179.804 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.445 -0.713 0 CA-C-O 120.68 0.276 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.18 -40.67 31.7 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.968 2.445 . . . . 0.0 113.493 -177.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 13.8 tp10 -64.3 -44.89 90.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.14 0.495 . . . . 0.0 109.888 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -65.96 -41.78 90.79 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.25 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.9 ttm105 -61.87 -46.86 87.6 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.409 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.62 93.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 79.4 mm-40 -70.04 -44.8 68.47 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.732 HD12 ' HB2' ' A' ' 34' ' ' ALA . 75.5 mt -71.21 -37.12 72.1 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.5 tp -69.28 -42.93 74.84 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 120.587 0.232 . . . . 0.0 111.387 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -64.98 -32.83 74.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.705 0.288 . . . . 0.0 110.89 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.92 -42.62 97.33 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.164 0.506 . . . . 0.0 109.642 176.066 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -62.13 -44.21 97.13 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.385 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -66.4 -41.09 89.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -65.37 -44.34 87.9 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.08 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.02 85.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -59.57 -37.54 78.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.116 0.484 . . . . 0.0 111.075 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -61.35 -34.71 75.74 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.856 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -93.33 -0.53 56.62 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.707 0.765 . . . . 0.0 110.163 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.84 -101.19 2.68 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.7 m 38.47 70.75 1.22 Allowed Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 123.594 0.758 . . . . 0.0 111.615 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HG2' ' A' ' 24' ' ' ARG . 44.8 Cg_exo -55.66 -42.92 62.7 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.578 2.185 . . . . 0.0 113.579 -174.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -72.24 -38.2 68.98 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.457 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -72.39 -43.54 63.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.369 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.441 ' HG2' ' HA ' ' A' ' 21' ' ' PRO . 38.2 ptt180 -64.31 -36.59 84.61 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.117 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.71 -44.42 96.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 111.267 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.51 -39.35 74.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.662 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 11' ' ' ALA . 64.8 mt -67.84 -39.54 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.063 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 26.5 mt -64.4 -36.99 85.94 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.834 177.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.636 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 87.6 m -63.57 -41.96 98.35 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 176.197 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.668 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.68 -36.07 81.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.384 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.95 95.88 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.9 176.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 36.8 mt-10 -70.55 -40.27 73.49 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.63 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 29' ' ' THR . 30.4 mmmt -64.11 -42.73 96.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.925 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.732 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.62 -35.88 77.24 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.817 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.42 -38.41 84.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.585 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.19 -26.6 67.48 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.19 0.519 . . . . 0.0 110.615 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 70.8 mt -77.3 -14.54 59.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.34 177.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.631 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 48.1 Cg_exo -57.71 -44.03 44.78 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.185 2.59 . . . . 0.0 113.543 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 7' ' ' GLN . 44.4 mt-10 -61.52 -45.22 95.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.001 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.94 -33.66 64.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.804 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -62.58 -44.39 96.43 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.51 98.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.835 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 3' ' ' GLU . 92.0 mt-30 -68.84 -46.48 68.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.0 111.015 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.619 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.3 mt -71.78 -39.62 69.82 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 58.3 tp -67.61 -41.92 83.21 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 120.534 0.207 . . . . 0.0 111.223 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.9 p -67.73 -33.08 74.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.078 0.466 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.478 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -66.23 -38.46 87.95 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.935 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -42.91 99.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.242 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 49.2 mt-10 -64.83 -41.51 95.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -66.47 -36.4 82.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.516 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.41 -38.39 86.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.079 0.466 . . . . 0.0 110.461 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.28 -44.42 75.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.052 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 52.5 mt-10 -67.53 -34.86 77.94 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.824 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.4 tp -82.81 -17.33 44.43 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.025 0.44 . . . . 0.0 110.46 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.35 32.18 62.7 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.711 176.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.2 m -92.5 105.52 14.68 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 116.86 0.33 . . . . 0.0 110.48 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 30.3 Cg_endo -64.09 -42.07 20.02 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.631 2.22 . . . . 0.0 113.369 -177.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.6 -43.69 75.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.137 0.494 . . . . 0.0 110.454 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.21 -38.79 65.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.823 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 21' ' ' PRO . 13.1 ptm180 -61.18 -38.62 87.16 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.0 96.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.947 0.403 . . . . 0.0 110.898 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -74.6 -40.93 61.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.235 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 15' ' ' ALA . 78.8 mt -72.43 -41.2 66.44 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -176.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.83 -42.09 90.98 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.767 -0.373 . . . . 0.0 111.213 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 p -67.23 -37.45 83.59 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 110.29 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.619 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.44 -39.1 93.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.002 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.57 93.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.675 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.93 -33.51 61.99 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.958 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 55.4 tptt -66.25 -42.3 88.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.721 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.607 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.26 -35.93 78.63 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.488 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.54 -39.86 85.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.167 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -63.07 -33.08 74.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.584 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.7 mt -78.09 -14.88 59.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.673 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.441 -1.017 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.753 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 120.488 0.185 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.539 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.9 Cg_exo -63.92 -37.89 41.48 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.027 2.484 . . . . 0.0 113.387 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.73 -44.76 92.62 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.95 0.405 . . . . 0.0 110.52 -178.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -68.82 -41.44 78.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.28 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -62.27 -46.33 89.28 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.475 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.77 98.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.787 0.327 . . . . 0.0 111.421 -178.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.7 -44.59 66.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.667 HD22 ' HB1' ' A' ' 30' ' ' ALA . 85.2 mt -70.91 -36.4 72.69 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 tp -68.86 -43.97 74.3 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 120.717 0.294 . . . . 0.0 110.94 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.7 p -64.02 -30.43 71.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.934 0.397 . . . . 0.0 110.341 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.559 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -60.91 -36.15 78.52 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.579 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.09 -44.89 96.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.876 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 0.8 OUTLIER -70.68 -37.65 73.66 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.161 177.465 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.616 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 64.7 tttm -64.26 -43.03 96.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.854 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.03 -34.94 77.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.038 0.447 . . . . 0.0 109.974 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -65.43 -44.29 87.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.579 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 53.1 mt-10 -62.44 -33.4 74.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.832 178.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -82.43 -13.5 56.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 74.73 37.16 46.01 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.855 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.6 m -113.1 91.87 19.95 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-O 120.75 0.31 . . . . 0.0 110.328 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 24.3 Cg_exo -64.82 -41.8 17.03 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.017 2.478 . . . . 0.0 113.159 -177.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.29 -43.53 86.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.345 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -37.47 78.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.761 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.49 -42.53 96.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.076 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.42 91.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.018 0.437 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -71.29 -40.14 71.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.559 HD22 ' HB1' ' A' ' 11' ' ' ALA . 67.5 mt -67.63 -33.09 74.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.078 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -64.86 -37.41 87.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.106 0.479 . . . . 0.0 110.404 176.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.0 m -66.75 -39.27 87.86 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.602 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.667 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.35 -38.88 92.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.793 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.87 -43.22 94.84 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.4 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.93 -39.48 69.41 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.254 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.87 -49.85 76.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.785 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.546 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.67 -35.62 78.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -67.64 -39.31 84.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.42 . . . . 0.0 110.484 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -66.25 -32.2 73.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.784 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.09 -14.57 60.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.782 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.539 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.013 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 32.5 Cg_exo -60.45 -44.44 27.49 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.317 2.678 . . . . 0.0 114.256 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.51 -45.69 86.17 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.927 0.394 . . . . 0.0 109.988 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -68.88 -38.33 79.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.572 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -62.19 -45.97 91.02 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.541 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.57 98.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.069 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.19 -47.44 67.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.999 0.428 . . . . 0.0 111.363 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.5 mt -71.83 -37.41 70.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 35.7 tp -69.03 -44.31 72.97 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.376 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 31.4 p -66.15 -32.79 74.45 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.025 0.441 . . . . 0.0 110.324 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.35 96.91 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.635 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -61.04 -40.62 94.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.533 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 47.0 mt-10 -64.89 -39.83 94.14 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.327 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 60.9 tttm -65.94 -35.73 81.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.838 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.549 ' HB2' HD23 ' A' ' 27' ' ' LEU . . . -64.84 -34.68 78.94 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.084 0.469 . . . . 0.0 110.069 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -66.6 -40.81 89.02 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.81 -28.97 70.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.202 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.8 mt -81.52 -16.6 51.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.164 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.71 34.68 42.9 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.936 -0.65 . . . . 0.0 113.168 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.4 p -117.22 91.68 37.61 Favored Pre-proline 0 C--N 1.319 -0.756 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 -43.73 52.53 Favored 'Trans proline' 0 N--CA 1.48 0.715 0 C-N-CA 123.431 2.754 . . . . 0.0 114.848 -175.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 42.2 tt0 -70.44 -44.72 67.26 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.044 -177.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -66.83 -34.63 78.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -62.96 -44.3 96.43 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.977 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.21 99.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.559 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 50.9 mm-40 -68.08 -41.31 82.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.212 0.53 . . . . 0.0 110.301 -179.254 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 15' ' ' ALA . 9.7 tp -72.82 -33.78 66.41 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.642 -179.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.432 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 13.0 mt -67.33 -33.76 75.93 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 120.805 0.336 . . . . 0.0 110.191 175.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.7 m -63.83 -36.71 84.81 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.62 -40.55 95.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.916 175.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.41 -43.71 96.45 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.065 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 43.5 mt-10 -71.89 -33.12 68.08 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.15 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -63.02 -47.4 83.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.519 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.511 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.915 0.388 . . . . 0.0 110.28 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.17 -45.4 93.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.287 176.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -66.35 -32.64 74.15 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.024 178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -13.98 59.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.619 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.513 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.452 0.168 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.44 -36.25 67.21 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.587 2.191 . . . . 0.0 111.522 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -63.44 -44.94 93.1 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.432 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.12 -42.67 62.66 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.196 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -61.62 -46.08 91.33 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.655 -177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.16 95.42 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.832 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -72.76 -45.76 56.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 111.89 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.725 HD22 ' HB1' ' A' ' 30' ' ' ALA . 95.2 mt -71.54 -36.81 71.1 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.4 tp -69.36 -40.92 77.21 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.4 p -66.74 -33.02 74.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.967 0.413 . . . . 0.0 110.209 178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.634 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.73 -37.37 87.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.994 176.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.11 93.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.995 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 41.7 mt-10 -70.09 -41.86 73.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.397 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.575 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 17.1 tppt? -63.84 -36.6 84.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.92 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.34 -39.43 90.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.051 0.453 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.0 -39.28 79.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 64.5 mm-40 -64.79 -22.81 67.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.646 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 87.1 mt -83.55 -16.25 46.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.688 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.65 20.74 79.74 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.889 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.2 t -109.2 103.54 52.72 Favored Pre-proline 0 C--N 1.32 -0.699 0 O-C-N 122.827 -0.22 . . . . 0.0 110.42 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -38.16 45.38 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.71 2.273 . . . . 0.0 113.082 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.12 -45.05 95.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.841 0.353 . . . . 0.0 110.75 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.52 -33.47 62.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.594 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' HD13 ' A' ' 28' ' ' LEU . 59.6 ttp180 -60.13 -45.3 93.49 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.236 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -41.44 93.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.838 0.351 . . . . 0.0 110.94 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -67.77 -43.26 80.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.14 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.735 HD12 ' HB2' ' A' ' 15' ' ' ALA . 51.1 mt -73.01 -33.04 65.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.738 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 24' ' ' ARG . 8.3 mp -66.12 -31.81 72.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 110.253 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 50.2 m -64.71 -44.08 91.37 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.725 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.58 -40.33 96.67 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.755 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.07 -40.5 89.71 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.134 0.492 . . . . 0.0 110.157 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -70.96 -40.97 71.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.466 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 33.8 mmtp -61.49 -41.14 96.82 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.324 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.711 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.44 -39.83 88.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.952 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -66.42 -42.92 87.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.717 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -62.38 -32.43 73.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.779 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 78.4 mt -77.02 -15.44 59.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.71 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.397 -179.089 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 120.447 0.165 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.85 -34.53 81.97 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.889 2.393 . . . . 0.0 111.242 177.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.64 -44.92 95.05 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.91 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -73.92 -37.7 64.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.942 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.445 ' NH2' ' HA ' ' A' ' 35' ' ' ASP . 42.2 ttm-85 -61.93 -47.22 85.9 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.443 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.62 -44.23 97.38 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -71.39 -45.0 63.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 98.4 mt -71.79 -41.2 68.59 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.71 -39.92 76.59 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -176.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.0 p -64.35 -32.02 73.47 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.939 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.11 -37.78 86.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.549 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.15 99.45 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.06 -41.63 77.32 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.833 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 87.7 tttt -64.67 -41.65 95.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.671 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.413 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.36 -34.93 77.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.657 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -68.25 -41.49 81.07 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.102 0.477 . . . . 0.0 110.045 178.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.42 -33.12 74.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.39 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.3 mt -81.85 -9.12 59.7 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.007 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.552 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.96 36.13 72.89 Favored Glycine 0 N--CA 1.441 -0.985 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.844 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.5 m -106.16 92.92 7.2 Favored Pre-proline 0 C--N 1.321 -0.633 0 C-N-CA 122.138 0.175 . . . . 0.0 110.695 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 23.4 Cg_exo -65.3 -42.35 13.57 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.614 2.209 . . . . 0.0 112.48 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -67.46 -44.28 78.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -72.34 -36.94 68.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -64.26 -36.45 84.14 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.453 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.19 92.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.032 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -71.58 -41.81 68.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.595 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.576 HD22 ' HB1' ' A' ' 11' ' ' ALA . 89.1 mt -68.45 -34.31 75.73 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.743 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -67.81 -34.81 77.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.849 0.357 . . . . 0.0 110.643 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.6 m -66.51 -35.61 80.68 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.89 -41.51 95.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.978 176.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.14 80.09 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.231 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 7.0 tp10 -71.64 -40.91 69.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.146 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.4 ttmt -66.06 -35.85 81.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.09 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.567 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.02 -36.86 82.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.721 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.445 ' HA ' ' NH2' ' A' ' 5' ' ' ARG . 25.0 t70 -65.8 -41.21 92.21 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.538 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 36.3 mt-10 -69.03 -25.73 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.302 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 85.0 mt -81.88 -15.36 54.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.811 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.399 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.401 -179.016 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 33.2 Cg_exo -61.06 -44.42 24.47 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.957 2.438 . . . . 0.0 112.883 -177.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -66.43 -44.57 82.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.86 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.24 -33.85 67.84 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.743 0.306 . . . . 0.0 110.562 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -62.36 -46.1 90.19 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.831 178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.85 -42.96 99.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.429 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.47 -44.14 79.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.608 HD22 ' HB1' ' A' ' 30' ' ' ALA . 50.1 mt -70.52 -36.58 73.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.567 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 tp -67.01 -43.71 82.18 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.703 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.7 p -67.95 -32.16 72.41 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.956 0.407 . . . . 0.0 110.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.49 85.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.013 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.41 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -61.71 -39.14 90.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.834 176.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 40.3 tt0 -70.01 -41.29 74.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.26 177.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -63.65 -43.45 96.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.942 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.427 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.7 -35.03 76.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.936 0.398 . . . . 0.0 110.248 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.28 -41.74 80.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.656 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 29.6 mm-40 -62.26 -33.31 74.38 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.964 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -87.76 -0.46 56.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.412 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.12 36.99 94.2 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.529 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.1 m -105.02 95.07 8.57 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.51 -42.32 21.9 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.818 2.345 . . . . 0.0 113.767 -177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -66.66 -44.56 81.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.053 0.454 . . . . 0.0 110.642 -178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -72.03 -35.82 69.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -62.06 -44.18 97.23 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.647 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.41 -43.7 96.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.119 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -42.52 84.38 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.144 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.484 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.2 mt -69.58 -37.92 77.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.534 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.41 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 25.7 mt -64.37 -36.64 84.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 0.0 110.277 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.455 HG22 ' HE3' ' A' ' 33' ' ' LYS . 50.4 m -70.74 -37.79 73.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.6 177.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.608 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.91 -35.96 81.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.61 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.54 94.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.145 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 47.9 mt-10 -72.24 -39.66 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.873 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 29' ' ' THR . 96.8 mttt -63.32 -40.36 97.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.456 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.01 78.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.368 0.604 . . . . 0.0 109.816 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.66 -39.94 95.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.64 178.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 46.2 mt-10 -62.98 -33.98 76.55 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.241 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.97 -13.84 59.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.003 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.536 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.798 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.074 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 13.0 p . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.496 0.188 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 35.9 Cg_endo -64.57 -44.7 10.48 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.897 2.398 . . . . 0.0 113.422 -177.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.73 -41.3 75.49 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 120.804 0.335 . . . . 0.0 111.109 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.39 -40.9 94.02 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -62.98 -40.75 98.69 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.328 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.57 96.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -69.64 -44.7 70.07 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.066 0.46 . . . . 0.0 111.051 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.632 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.8 mt -71.05 -37.78 72.52 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.05 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 11.6 tp -67.43 -44.26 79.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.034 -178.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -64.02 -37.41 87.31 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.333 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.47 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.92 -38.75 92.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.132 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.27 96.9 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.966 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 46.9 mm-40 -64.62 -40.82 96.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.453 178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.642 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -66.45 -45.66 79.03 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.872 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.79 78.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.79 -38.12 88.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.945 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -71.7 -29.2 64.3 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.64 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 72.5 mt -81.33 -16.28 52.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.639 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.51 26.37 61.32 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.546 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.6 t -103.28 104.42 40.84 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.43 -41.86 30.76 Favored 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.888 2.392 . . . . 0.0 113.445 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.27 -44.83 95.64 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.881 0.372 . . . . 0.0 111.478 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -74.79 -38.98 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.581 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.404 ' HG2' HD12 ' A' ' 28' ' ' LEU . 69.0 ttt-85 -60.13 -44.74 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.269 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.12 82.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.965 0.412 . . . . 0.0 111.186 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -65.85 -41.74 91.31 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.76 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.47 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.7 mt -74.17 -37.4 63.99 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.257 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.404 HD12 ' HG2' ' A' ' 24' ' ' ARG . 19.7 mt -64.5 -40.64 96.02 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.403 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.9 p -69.43 -32.58 71.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.01 0.433 . . . . 0.0 110.322 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.632 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -67.18 -40.88 86.65 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.083 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB1' HD12 ' A' ' 9' ' ' LEU . . . -59.91 -42.97 95.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.232 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -71.7 -33.6 68.93 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.432 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 40.7 ttmt -64.05 -49.81 70.88 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.639 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.64 -34.75 76.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.145 0.498 . . . . 0.0 110.339 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.05 -41.17 99.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.081 177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -66.02 -31.78 72.88 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.44 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.1 mt -75.94 -13.55 60.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.376 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.059 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.883 -179.297 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.668 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 26.0 Cg_exo -63.91 -44.36 13.3 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.019 2.479 . . . . 0.0 112.98 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.36 -43.69 92.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.866 0.365 . . . . 0.0 111.219 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.25 -39.35 65.5 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.372 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -61.77 -43.53 98.68 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.9 -42.95 99.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.232 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -70.97 -44.61 65.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.882 0.372 . . . . 0.0 111.38 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.604 HD22 ' HB1' ' A' ' 30' ' ' ALA . 67.4 mt -70.12 -39.05 75.67 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.157 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.87 -40.58 79.19 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.236 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.402 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 13.8 p -67.32 -34.11 76.68 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.362 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.478 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.66 -39.75 94.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.903 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.97 94.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.963 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 34.0 tt0 -70.56 -41.36 72.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.172 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 10' ' ' THR . 2.3 mptm? -63.92 -44.17 93.71 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.565 0.221 . . . . 0.0 111.068 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.8 78.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.969 0.414 . . . . 0.0 109.961 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.35 -45.6 79.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.231 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 50.3 mt-10 -62.08 -34.73 76.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.627 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -82.29 -7.82 59.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.958 0.408 . . . . 0.0 111.483 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.568 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 76.15 32.43 52.46 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.105 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -101.36 95.64 5.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.568 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 21.9 Cg_exo -65.23 -42.6 13.08 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.87 2.38 . . . . 0.0 113.282 -176.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -69.58 -44.16 71.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.772 0.32 . . . . 0.0 110.868 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.3 -38.95 88.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.223 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -60.57 -45.17 94.93 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.14 94.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.788 0.328 . . . . 0.0 111.267 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -67.79 -40.84 83.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.478 HD22 ' CB ' ' A' ' 11' ' ' ALA . 65.4 mt -70.02 -35.57 74.45 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.145 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.5 mt -66.53 -32.01 73.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.329 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -62.79 -40.89 98.74 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.604 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -70.78 -38.66 73.41 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.228 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.12 94.13 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.689 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -72.83 -37.45 67.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.734 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -68.7 -48.6 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.748 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.19 -34.6 72.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.559 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.83 -42.4 98.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.336 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -63.78 -35.75 81.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.582 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.46 -14.66 59.64 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 120.992 0.425 . . . . 0.0 110.867 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.668 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.433 -1.541 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.652 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.441 0.162 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.541 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.6 Cg_exo -63.86 -44.08 14.28 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.024 2.483 . . . . 0.0 113.488 -177.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.45 -44.5 90.92 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.867 0.365 . . . . 0.0 110.611 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -66.14 -35.67 81.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.037 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.9 -43.86 97.64 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.445 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.05 -42.65 98.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.947 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -69.78 -44.01 70.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 111.441 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 30' ' ' ALA . 86.6 mt -70.44 -39.14 74.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.1 tp -69.1 -41.11 77.9 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.741 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.5 p -64.46 -32.82 74.61 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.596 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.477 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.51 -38.05 89.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.175 176.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -44.3 96.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.828 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -66.63 -39.68 88.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.286 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -68.07 -33.65 74.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.284 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.938 0.399 . . . . 0.0 110.362 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.16 -41.91 85.21 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.6 -34.72 76.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.509 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.63 -17.48 41.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.931 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.89 33.38 65.95 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.072 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 21' ' ' PRO . 4.5 p -105.87 101.25 32.24 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.958 0.379 . . . . 0.0 110.699 179.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 20' ' ' CYS . 30.7 Cg_endo -62.19 -39.99 44.6 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.069 2.513 . . . . 0.0 114.346 -175.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.37 -43.25 86.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.125 0.488 . . . . 0.0 110.624 -177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.52 -38.75 62.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.324 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -59.62 -44.66 93.36 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.02 -178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.65 93.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.008 -179.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -68.82 -42.26 77.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.976 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.477 HD22 ' CB ' ' A' ' 11' ' ' ALA . 66.6 mt -67.1 -34.42 77.59 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.541 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 19.9 mt -67.01 -39.41 87.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.334 176.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.2 m -65.52 -35.17 80.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.069 0.461 . . . . 0.0 109.836 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.16 -39.07 93.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.196 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.92 97.94 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.212 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 37.4 mt-10 -71.95 -39.81 69.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.035 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 88.6 tttt -65.12 -40.54 94.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.13 -35.18 74.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.568 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.13 -44.51 91.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.168 176.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.64 -29.49 69.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.148 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 68.1 mt -78.92 -14.57 59.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.681 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.541 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.446 -0.664 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.294 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.554 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 16.6 m . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.18 -44.22 12.83 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.918 2.412 . . . . 0.0 113.679 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 37.7 tt0 -65.88 -43.79 87.3 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.892 -177.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.554 ' OE1' ' HB3' ' A' ' 1' ' ' SER . 20.0 mp0 -65.19 -39.5 92.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 58.0 ttp180 -62.03 -45.2 94.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.82 99.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.665 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 71.1 mm-40 -63.81 -43.15 97.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.059 0.456 . . . . 0.0 110.74 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.599 HD22 ' HB1' ' A' ' 30' ' ' ALA . 45.7 mt -70.5 -40.38 73.59 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.372 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -68.7 -40.08 80.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.472 -178.508 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 6.2 p -64.41 -37.35 87.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.861 0.362 . . . . 0.0 110.114 177.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.504 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.83 -36.97 84.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.425 177.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.32 -40.75 91.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.567 177.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -68.79 -41.26 78.97 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.394 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.606 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 29.2 mtpp -64.22 -44.69 91.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.323 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.9 -37.12 86.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.993 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.57 -44.2 78.76 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.959 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.15 -31.78 72.3 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.522 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 54.3 mt -82.76 -9.34 59.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.22 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.71 39.69 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.755 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 m -114.48 92.04 26.82 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.784 0.326 . . . . 0.0 110.743 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.84 -42.19 15.77 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.118 2.545 . . . . 0.0 113.118 -177.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 11.3 mp0 -62.43 -43.79 97.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.728 0.299 . . . . 0.0 110.678 -178.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.89 -39.54 79.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.042 0.449 . . . . 0.0 110.138 178.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -60.07 -43.6 95.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.665 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.12 88.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.408 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 58.6 mm-40 -72.12 -37.09 69.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.09 0.472 . . . . 0.0 110.899 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.504 HD22 ' CB ' ' A' ' 11' ' ' ALA . 43.8 mt -73.27 -36.21 66.31 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.072 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 32.3 mt -67.21 -39.5 86.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.206 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.2 p -70.98 -32.82 69.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.153 0.502 . . . . 0.0 110.388 178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.599 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.19 -40.43 97.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.287 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -40.57 88.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.409 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.65 -39.79 80.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.244 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -68.43 -40.88 81.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.655 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.84 -35.26 79.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.476 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.44 -36.97 84.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.312 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.53 -33.05 74.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.158 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.9 -14.29 59.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.818 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.022 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.617 -178.232 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 CA--C 1.54 0.573 0 CA-C-O 120.591 0.234 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.3 Cg_exo -63.82 -45.33 11.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.148 2.565 . . . . 0.0 113.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.27 -44.22 88.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.467 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -66.29 -39.71 89.55 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.962 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -64.33 -39.51 94.05 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.146 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.71 -42.59 93.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.827 0.346 . . . . 0.0 111.322 -177.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -69.57 -44.13 71.47 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.694 HD22 ' HB1' ' A' ' 30' ' ' ALA . 88.8 mt -70.4 -37.7 74.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.281 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.3 tp -68.9 -39.71 79.55 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -67.48 -32.49 73.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.919 0.39 . . . . 0.0 110.303 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.81 -40.42 97.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.87 175.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.857 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -64.72 -41.21 96.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.161 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.401 ' O ' HD23 ' A' ' 18' ' ' LEU . 84.5 tttt -64.51 -45.82 85.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.994 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -65.99 -34.96 79.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -68.39 -38.95 81.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.01 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -66.95 -35.26 79.57 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.83 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.401 HD23 ' O ' ' A' ' 14' ' ' LYS . 4.1 mm? -81.03 -11.76 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.3 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.74 24.84 73.49 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.919 178.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.6 t -95.27 101.98 8.66 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.14 -43.0 12.23 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.806 2.337 . . . . 0.0 114.532 -173.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -71.36 -43.3 67.19 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.442 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.74 -35.06 78.06 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.277 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HG2' HD12 ' A' ' 28' ' ' LEU . 57.5 ttp180 -61.54 -43.97 97.9 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.122 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -43.62 98.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.776 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -65.92 -43.02 89.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.775 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 11' ' ' ALA . 83.5 mt -73.28 -35.85 66.22 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.844 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD12 ' HG2' ' A' ' 24' ' ' ARG . 15.5 mt -67.58 -33.61 75.37 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.755 0.312 . . . . 0.0 110.511 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.9 m -63.82 -40.83 97.55 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.694 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -66.67 -39.84 88.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.628 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -43.82 95.35 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.246 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 64.5 mm-40 -73.09 -39.68 65.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.156 177.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.627 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.7 tptt -54.54 -55.69 26.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.953 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.87 -34.55 74.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.099 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.02 -42.33 97.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.113 177.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 57.5 mm-40 -65.67 -34.17 77.59 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.319 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 73.3 mt -76.67 -14.8 59.94 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.583 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.489 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.445 -0.728 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.59 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.739 0.304 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -63.94 -34.84 58.22 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.057 2.505 . . . . 0.0 112.09 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.08 -44.38 89.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.182 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -70.53 -33.9 71.68 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.66 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -62.37 -42.06 99.1 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.706 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.44 -42.92 99.5 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.923 0.392 . . . . 0.0 110.867 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.75 -40.6 88.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.211 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.546 HD22 ' HB1' ' A' ' 30' ' ' ALA . 53.1 mt -69.83 -37.94 76.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.445 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -65.39 -41.22 93.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.243 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -72.0 -32.18 66.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.939 0.4 . . . . 0.0 110.229 177.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.496 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.38 -37.76 86.98 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.436 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -60.76 -43.82 97.53 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.726 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.91 -33.88 72.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.339 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -65.13 -46.11 82.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.869 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.79 -36.32 83.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.957 0.408 . . . . 0.0 110.799 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.14 -41.24 94.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.863 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.09 -34.49 78.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.866 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.09 -11.84 58.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.03 34.79 29.24 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.046 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.1 m -111.19 90.82 12.2 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.04 -42.04 15.25 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.788 2.325 . . . . 0.0 113.353 -176.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.7 -43.14 80.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.607 0.241 . . . . 0.0 110.795 -177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.72 -38.62 87.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.51 -44.88 95.56 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.673 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.87 90.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.268 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -69.28 -40.94 77.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.496 HD22 ' HB1' ' A' ' 11' ' ' ALA . 61.8 mt -68.58 -33.52 74.2 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.155 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 44.5 mt -66.32 -42.98 87.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.22 177.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.3 p -65.69 -31.78 72.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.86 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.9 -34.38 77.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.9 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.67 92.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.857 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.6 -40.29 66.64 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.972 0.415 . . . . 0.0 111.019 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.604 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 61.3 mmtt -65.12 -35.04 79.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.919 -178.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.24 -35.57 79.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.686 0.279 . . . . 0.0 110.901 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -67.65 -42.49 82.15 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.02 -33.36 75.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.678 177.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.6 mt -76.92 -14.46 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.87 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.47 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.542 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 25.7 Cg_exo -63.09 -41.96 25.7 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.081 2.52 . . . . 0.0 113.556 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.72 -46.15 69.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.767 0.318 . . . . 0.0 111.15 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.8 -34.0 73.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.542 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.55 ' HG2' HD12 ' A' ' 9' ' ' LEU . 43.7 ttt180 -62.72 -45.33 93.23 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.739 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.68 -42.21 98.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.798 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -63.38 -44.48 94.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.852 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.547 HD22 ' HB1' ' A' ' 30' ' ' ALA . 55.8 mt -70.03 -40.6 75.07 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.614 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.55 HD12 ' HG2' ' A' ' 5' ' ' ARG . 13.6 mt -67.08 -36.08 81.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.984 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 14.2 p -71.99 -36.77 69.85 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.94 177.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.54 -37.35 85.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.164 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -60.71 -42.32 97.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.724 176.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -69.75 -41.07 75.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.286 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 32.4 mmtp -66.24 -40.55 90.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.597 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.07 -35.09 79.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.409 . . . . 0.0 110.384 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.85 -40.77 88.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.888 177.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -65.12 -28.39 69.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.325 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 85.0 mt -82.24 -11.18 58.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.718 178.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.76 50.08 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.724 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -114.54 91.84 26.34 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.33 -39.82 27.91 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.843 2.362 . . . . 0.0 112.802 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 33.0 tt0 -67.12 -43.17 83.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.723 0.297 . . . . 0.0 110.505 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -64.49 -42.2 96.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 56.3 ttt180 -60.73 -43.03 98.41 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.461 178.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.95 97.59 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.063 0.459 . . . . 0.0 111.155 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 90.6 mt-30 -65.73 -41.14 92.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD22 ' CB ' ' A' ' 11' ' ' ALA . 37.6 mt -73.54 -36.18 65.64 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.739 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.3 mt -66.73 -37.48 84.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.416 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -70.94 -31.85 68.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.158 0.504 . . . . 0.0 110.082 177.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.547 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.61 -35.2 80.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.21 82.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.72 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -69.49 -40.38 77.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.892 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -61.69 -49.23 77.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.837 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.455 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.12 -35.27 80.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.407 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.17 -46.67 87.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.514 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.91 -27.13 67.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.14 0.495 . . . . 0.0 110.321 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -76.77 -14.65 59.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.896 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.542 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.617 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.909 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.77 -42.34 20.52 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.888 2.392 . . . . 0.0 113.892 -175.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -67.66 -46.11 73.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.021 0.439 . . . . 0.0 111.264 -177.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.13 -32.83 71.01 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.819 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.48 ' HG2' HD12 ' A' ' 9' ' ' LEU . 63.9 ttt-85 -61.5 -46.2 91.01 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.955 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.6 -43.24 94.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.59 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -66.35 -42.83 87.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.687 0.28 . . . . 0.0 111.682 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.523 HD22 ' HB1' ' A' ' 30' ' ' ALA . 68.5 mt -69.63 -38.31 77.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.727 0.298 . . . . 0.0 111.514 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.544 ' HG ' ' HB1' ' A' ' 31' ' ' ALA . 11.6 mt -67.45 -38.85 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.867 178.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -72.0 -32.81 67.55 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.577 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.485 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.39 -37.33 85.31 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.827 176.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.496 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.86 -44.55 96.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.285 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.12 -40.61 71.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.109 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.34 -37.2 86.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.537 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -37.98 88.63 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.479 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.61 -41.6 96.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.78 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.22 -34.79 75.69 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.612 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.3 tp -90.06 0.14 57.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.284 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.64 -92.99 1.51 Allowed Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -177.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' GLU . 36.1 m 25.32 70.18 0.39 Allowed Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.116 1.366 . . . . 0.0 113.769 175.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.3 -41.86 46.82 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.407 2.071 . . . . 0.0 112.78 -177.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.24 -44.23 63.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.917 0.389 . . . . 0.0 111.283 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 20' ' ' CYS . 31.5 mt-10 -66.08 -34.86 79.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.152 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 67.3 ttt180 -61.03 -43.47 98.84 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.184 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.25 95.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.566 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.29 -41.9 99.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.658 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.485 HD22 ' CB ' ' A' ' 11' ' ' ALA . 48.2 mt -68.92 -38.35 79.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.055 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.496 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 37.1 mt -65.69 -32.51 74.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 176.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.0 m -68.04 -40.28 82.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.731 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.523 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.18 -35.76 81.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.685 177.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HG ' ' A' ' 9' ' ' LEU . . . -59.27 -43.27 92.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.861 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -72.69 -39.45 67.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 ttmt -63.12 -45.64 91.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.897 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.04 -34.94 79.62 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.049 0.452 . . . . 0.0 110.225 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.28 -43.72 97.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.409 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.99 -30.53 71.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.971 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.3 mt -76.91 -13.41 59.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.991 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.007 0 C-N-CA 120.688 -0.767 . . . . 0.0 111.823 -178.561 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -58.84 -44.31 36.85 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.133 2.555 . . . . 0.0 113.638 -177.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -64.59 -42.93 95.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.842 0.354 . . . . 0.0 111.41 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -73.38 -34.3 65.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.274 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -62.34 -45.1 94.73 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.992 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.77 99.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.274 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -68.66 -44.88 73.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.923 -179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.645 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.7 mt -70.52 -36.42 73.73 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.916 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.1 tp -68.85 -40.79 79.15 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.944 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.5 p -68.19 -32.8 73.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.122 0.487 . . . . 0.0 110.043 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.525 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.63 -37.23 85.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.86 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.91 94.09 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.545 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 31.2 mt-10 -70.25 -34.45 72.85 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.079 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.476 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 55.2 mttp -63.5 -44.8 93.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.593 0.235 . . . . 0.0 110.915 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.55 78.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.123 0.487 . . . . 0.0 109.798 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -64.03 -42.65 97.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.574 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 24.2 mm-40 -62.01 -34.32 75.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.836 177.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -81.55 -15.97 53.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.798 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.37 33.31 48.95 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.793 179.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -113.82 97.79 45.57 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.046 0.451 . . . . 0.0 110.944 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.14 -37.04 86.49 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 123.123 2.549 . . . . 0.0 113.341 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.54 -46.0 90.38 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.779 0.323 . . . . 0.0 111.204 -176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -76.43 -35.3 58.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.862 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -60.75 -43.25 98.21 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.322 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.71 95.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.651 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -65.37 -42.89 92.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.525 HD22 ' HB1' ' A' ' 11' ' ' ALA . 60.2 mt -71.38 -35.78 71.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.654 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.1 mt -66.16 -34.4 77.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.922 0.391 . . . . 0.0 110.414 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.5 m -64.78 -36.84 85.61 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.419 0.628 . . . . 0.0 109.361 176.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.645 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -69.45 -38.68 77.91 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.641 178.055 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.49 93.75 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.903 177.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -70.75 -40.48 72.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.625 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -64.72 -43.19 94.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.015 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.62 -35.14 79.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.457 . . . . 0.0 110.434 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.06 -42.87 84.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.258 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -63.47 -35.4 80.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.036 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 37' ' ' LEU . 1.9 tm? -77.1 -14.89 59.74 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.221 0.534 . . . . 0.0 110.13 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.824 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.92 -179.474 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 110.555 -0.165 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.1 Cg_exo -64.14 -45.07 10.74 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.797 2.332 . . . . 0.0 113.019 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 59.2 mm-40 -68.22 -42.94 79.04 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.709 0.29 . . . . 0.0 111.145 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -66.01 -39.68 90.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.426 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -62.24 -43.49 98.71 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.323 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.87 -42.91 98.83 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.121 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.8 mm100 -70.01 -44.39 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.939 0.399 . . . . 0.0 111.379 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.62 HD22 ' HB1' ' A' ' 30' ' ' ALA . 79.2 mt -71.09 -38.31 72.41 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.34 -178.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.38 -44.01 79.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 120.644 0.259 . . . . 0.0 111.066 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.8 p -67.15 -32.66 73.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.5 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.41 -37.41 85.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.248 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.466 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.56 -39.22 87.18 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.791 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.54 -39.68 73.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.269 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -64.61 -45.14 88.17 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.912 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.78 -36.32 80.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.924 0.393 . . . . 0.0 110.814 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.81 -44.76 84.71 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.192 0.52 . . . . 0.0 109.615 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.22 -31.68 72.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.056 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 95.3 mt -82.46 -16.01 50.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.518 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.98 29.86 27.48 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.227 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.5 m -102.72 97.84 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.77 -43.86 9.03 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.36 2.04 . . . . 0.0 113.435 -176.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.52 -42.92 64.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.029 0.442 . . . . 0.0 110.594 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.78 -34.26 77.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.017 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -59.91 -44.73 94.12 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -39.26 77.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.941 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -63.26 -42.49 99.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.095 0.474 . . . . 0.0 110.556 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.515 HD12 ' HB2' ' A' ' 15' ' ' ALA . 57.6 mt -75.3 -35.84 61.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.922 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 18.5 mt -64.18 -39.35 93.8 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 p -70.96 -34.63 71.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.944 0.402 . . . . 0.0 110.075 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.62 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.76 -35.82 81.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.447 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.95 90.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.76 177.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -71.66 -40.12 69.86 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.905 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 65.2 mttm -57.19 -54.8 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.426 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.83 -35.89 79.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.89 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.05 -42.36 89.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.405 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.94 -33.59 76.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.169 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.8 mt -79.41 -14.45 58.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.386 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.571 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.781 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.207 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 68.6 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 30.7 Cg_endo -63.36 -38.38 43.75 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.97 2.447 . . . . 0.0 112.787 -177.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -69.45 -44.04 72.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 0.0 110.282 -178.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -66.63 -36.68 83.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.805 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.494 ' HD3' ' OD1' ' A' ' 35' ' ' ASP . 8.8 ttm180 -61.68 -46.44 89.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.642 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.92 -39.91 91.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.19 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.86 -45.75 84.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.723 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.734 HD23 ' HB2' ' A' ' 34' ' ' ALA . 0.5 OUTLIER -71.66 -43.77 65.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.472 HD13 ' HG2' ' A' ' 5' ' ' ARG . 10.5 mp -62.35 -37.85 87.27 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.412 -178.291 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 21.9 p -72.09 -32.45 67.03 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.274 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.63 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.46 85.75 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.612 177.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.85 97.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.603 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.17 -37.2 78.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.395 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 68.5 mttm -64.75 -36.44 84.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.634 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -66.22 -35.38 80.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.984 177.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.29 -43.14 99.37 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.809 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -67.25 -34.76 78.14 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.756 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 76.8 mt -81.88 -17.59 46.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.096 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.403 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.84 28.82 71.5 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 113.016 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 23' ' ' GLU . 4.0 p -105.14 102.17 34.77 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.906 0.384 . . . . 0.0 111.168 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 43.0 Cg_exo -57.78 -41.71 67.03 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.264 2.643 . . . . 0.0 113.62 -177.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.86 -44.81 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.334 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 34.7 mt-10 -69.63 -36.13 75.85 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.975 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -60.97 -44.37 97.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.77 97.9 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.87 0.367 . . . . 0.0 111.181 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.85 -41.13 71.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.235 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.63 HD22 ' HB1' ' A' ' 11' ' ' ALA . 78.2 mt -67.39 -34.34 77.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.717 0.294 . . . . 0.0 111.091 178.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.2 mt -69.49 -32.49 71.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.545 175.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.8 m -67.75 -43.95 78.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.506 ' HB1' ' HG ' ' A' ' 8' ' ' LEU . . . -63.31 -39.27 94.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.351 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.593 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . . . -62.03 -44.53 96.5 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.158 0.504 . . . . 0.0 110.42 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 5.7 tp10 -67.29 -39.5 85.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.01 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -66.28 -41.02 90.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.216 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.734 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -62.25 -36.73 82.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.317 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' OD1' ' HD3' ' A' ' 5' ' ' ARG . 4.5 m-20 -60.87 -41.88 96.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.734 176.081 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 38.0 mt-10 -70.38 -33.48 71.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.375 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.85 -14.23 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.738 0.304 . . . . 0.0 111.255 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.436 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.385 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -61.48 -44.36 22.92 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.038 2.492 . . . . 0.0 114.227 -173.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.82 -45.11 75.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.025 0.441 . . . . 0.0 110.461 -177.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.78 -34.96 76.44 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.516 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.515 ' O ' HD23 ' A' ' 9' ' ' LEU . 35.6 ttp180 -62.53 -47.75 82.52 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.994 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.85 95.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.137 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -68.97 -45.28 71.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.563 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 30' ' ' ALA . 58.9 mt -70.63 -41.67 71.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 5' ' ' ARG . 4.2 mm? -63.0 -42.55 99.88 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-O 120.769 0.319 . . . . 0.0 111.03 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.9 p -70.1 -35.17 73.96 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.189 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.466 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.45 -38.94 91.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.246 177.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -43.85 98.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.281 0.562 . . . . 0.0 109.502 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 13.9 mm-40 -68.02 -40.8 82.85 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.372 179.273 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 96.5 mttt -67.81 -37.63 82.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.412 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.1 -35.15 79.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.138 0.495 . . . . 0.0 109.945 176.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.42 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 16.3 t70 -63.76 -44.65 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.374 175.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 96.3 mt-10 -65.75 -28.77 69.28 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.333 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 47.7 mt -82.84 -11.78 57.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.855 0.36 . . . . 0.0 111.086 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.36 50.38 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.363 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.5 m -116.28 89.07 25.03 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.59 -37.13 38.93 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.703 2.269 . . . . 0.0 112.73 -177.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -64.57 -43.88 92.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.568 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -73.59 -34.64 65.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.311 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -60.02 -43.91 94.96 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.423 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.887 0.375 . . . . 0.0 110.836 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.83 -40.13 94.69 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.338 0.589 . . . . 0.0 110.308 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.466 HD22 ' CB ' ' A' ' 11' ' ' ALA . 45.0 mt -74.7 -34.64 62.67 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.198 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.3 mt -65.27 -42.4 93.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.301 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 p -64.22 -36.1 82.98 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.25 0.548 . . . . 0.0 109.941 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.489 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -69.3 -40.41 77.71 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.315 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 9' ' ' LEU . . . -60.59 -43.73 97.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.727 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -66.34 -40.03 89.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.892 -178.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -73.11 -35.11 66.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.483 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -64.42 -38.06 89.69 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.834 0.35 . . . . 0.0 110.971 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -63.21 -47.51 82.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.801 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.0 -21.18 61.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.949 0.404 . . . . 0.0 111.112 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.26 -15.69 59.96 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.279 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.578 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.721 179.277 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 120.948 0.404 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -57.39 -34.62 98.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.945 2.43 . . . . 0.0 112.83 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.15 -44.01 93.45 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.862 0.363 . . . . 0.0 110.853 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -72.27 -35.68 68.81 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.439 ' HA ' ' CB ' ' A' ' 34' ' ' ALA . 56.3 ttp180 -62.38 -46.18 89.8 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.897 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.01 97.85 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.91 0.386 . . . . 0.0 110.892 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -67.59 -46.08 73.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.282 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.666 HD12 ' HB2' ' A' ' 34' ' ' ALA . 65.8 mt -72.26 -40.41 67.68 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.53 -41.92 88.01 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 15.6 p -64.11 -38.12 89.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.371 . . . . 0.0 110.297 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.439 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.23 -38.67 91.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.168 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.475 ' HB1' HD23 ' A' ' 28' ' ' LEU . . . -62.13 -42.67 99.47 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.935 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.82 -41.35 91.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.569 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 10' ' ' THR . 97.5 mttt -63.85 -44.43 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.68 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.36 -43.52 85.79 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.948 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' HD2' ' A' ' 24' ' ' ARG . 17.9 t70 -59.17 -42.99 92.09 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.019 0.438 . . . . 0.0 110.963 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.97 -35.07 77.4 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.523 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.2 tp -93.31 -17.0 24.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.95 0.405 . . . . 0.0 111.551 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.19 -99.91 1.57 Allowed Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.0 m 42.21 79.68 0.32 Allowed Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 123.543 0.737 . . . . 0.0 111.801 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.56 -43.87 53.94 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 122.736 2.291 . . . . 0.0 113.896 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -74.11 -43.45 57.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.88 0.372 . . . . 0.0 111.633 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.24 -43.24 74.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.502 -177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.417 ' HD2' ' OD1' ' A' ' 16' ' ' ASP . 9.5 ttp180 -62.18 -44.37 96.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.635 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.91 96.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.574 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -73.18 -38.89 65.99 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.941 -178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.439 HD22 ' CB ' ' A' ' 11' ' ' ALA . 70.7 mt -70.73 -38.32 73.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.702 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.475 HD23 ' HB1' ' A' ' 12' ' ' ALA . 29.0 mt -67.08 -39.63 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.664 0.269 . . . . 0.0 111.36 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -71.0 -33.22 70.19 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.865 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.19 -36.04 82.78 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.372 176.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.22 96.02 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.847 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -71.97 -40.33 68.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.899 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 69.1 mmtt -66.91 -36.45 82.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.545 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.21 -41.6 99.17 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.155 0.502 . . . . 0.0 110.387 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.56 -38.12 83.67 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.553 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.44 -33.62 74.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.491 177.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 95.6 mt -76.68 -15.48 59.78 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.126 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.004 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.787 -179.804 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.445 -0.713 0 CA-C-O 120.68 0.276 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.18 -40.67 31.7 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.968 2.445 . . . . 0.0 113.493 -177.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 13.8 tp10 -64.3 -44.89 90.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.14 0.495 . . . . 0.0 109.888 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -65.96 -41.78 90.79 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.25 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.9 ttm105 -61.87 -46.86 87.6 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.409 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.62 93.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 79.4 mm-40 -70.04 -44.8 68.47 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.732 HD12 ' HB2' ' A' ' 34' ' ' ALA . 75.5 mt -71.21 -37.12 72.1 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.5 tp -69.28 -42.93 74.84 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 120.587 0.232 . . . . 0.0 111.387 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -64.98 -32.83 74.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.705 0.288 . . . . 0.0 110.89 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.92 -42.62 97.33 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.164 0.506 . . . . 0.0 109.642 176.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -62.13 -44.21 97.13 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.385 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -66.4 -41.09 89.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -65.37 -44.34 87.9 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.08 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.02 85.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -59.57 -37.54 78.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.116 0.484 . . . . 0.0 111.075 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -61.35 -34.71 75.74 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.856 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -93.33 -0.53 56.62 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.707 0.765 . . . . 0.0 110.163 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.84 -101.19 2.68 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.7 m 38.47 70.75 1.22 Allowed Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 123.594 0.758 . . . . 0.0 111.615 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HG2' ' A' ' 24' ' ' ARG . 44.8 Cg_exo -55.66 -42.92 62.7 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.578 2.185 . . . . 0.0 113.579 -174.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -72.24 -38.2 68.98 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.457 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -72.39 -43.54 63.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.369 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.441 ' HG2' ' HA ' ' A' ' 21' ' ' PRO . 38.2 ptt180 -64.31 -36.59 84.61 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.117 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.71 -44.42 96.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 111.267 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.51 -39.35 74.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.662 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 11' ' ' ALA . 64.8 mt -67.84 -39.54 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.063 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 26.5 mt -64.4 -36.99 85.94 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.834 177.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.636 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 87.6 m -63.57 -41.96 98.35 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 176.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.668 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.68 -36.07 81.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.384 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.95 95.88 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.9 176.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 36.8 mt-10 -70.55 -40.27 73.49 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.63 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 29' ' ' THR . 30.4 mmmt -64.11 -42.73 96.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.925 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.732 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.62 -35.88 77.24 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.817 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.42 -38.41 84.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.585 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.19 -26.6 67.48 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.19 0.519 . . . . 0.0 110.615 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 70.8 mt -77.3 -14.54 59.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.34 177.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.631 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 48.1 Cg_exo -57.71 -44.03 44.78 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.185 2.59 . . . . 0.0 113.543 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 7' ' ' GLN . 44.4 mt-10 -61.52 -45.22 95.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.001 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.94 -33.66 64.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.804 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -62.58 -44.39 96.43 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.51 98.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.835 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 3' ' ' GLU . 92.0 mt-30 -68.84 -46.48 68.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.0 111.015 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.619 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.3 mt -71.78 -39.62 69.82 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 58.3 tp -67.61 -41.92 83.21 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 120.534 0.207 . . . . 0.0 111.223 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.9 p -67.73 -33.08 74.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.078 0.466 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.478 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -66.23 -38.46 87.95 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.935 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -42.91 99.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.242 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 49.2 mt-10 -64.83 -41.51 95.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -66.47 -36.4 82.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.516 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.41 -38.39 86.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.079 0.466 . . . . 0.0 110.461 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.28 -44.42 75.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.052 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 52.5 mt-10 -67.53 -34.86 77.94 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.824 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.4 tp -82.81 -17.33 44.43 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.025 0.44 . . . . 0.0 110.46 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.35 32.18 62.7 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.711 176.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.2 m -92.5 105.52 14.68 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 116.86 0.33 . . . . 0.0 110.48 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 30.3 Cg_endo -64.09 -42.07 20.02 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.631 2.22 . . . . 0.0 113.369 -177.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.6 -43.69 75.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.137 0.494 . . . . 0.0 110.454 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.21 -38.79 65.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.823 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 21' ' ' PRO . 13.1 ptm180 -61.18 -38.62 87.16 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.0 96.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.947 0.403 . . . . 0.0 110.898 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -74.6 -40.93 61.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.235 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 15' ' ' ALA . 78.8 mt -72.43 -41.2 66.44 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -176.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.83 -42.09 90.98 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.767 -0.373 . . . . 0.0 111.213 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 p -67.23 -37.45 83.59 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 110.29 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.619 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.44 -39.1 93.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.002 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.57 93.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.675 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.93 -33.51 61.99 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.958 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 55.4 tptt -66.25 -42.3 88.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.721 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.607 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.26 -35.93 78.63 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.488 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.54 -39.86 85.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.167 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -63.07 -33.08 74.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.584 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.7 mt -78.09 -14.88 59.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.673 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.441 -1.017 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.753 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 120.488 0.185 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.539 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.9 Cg_exo -63.92 -37.89 41.48 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.027 2.484 . . . . 0.0 113.387 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.73 -44.76 92.62 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.95 0.405 . . . . 0.0 110.52 -178.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -68.82 -41.44 78.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.28 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -62.27 -46.33 89.28 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.475 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.77 98.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.787 0.327 . . . . 0.0 111.421 -178.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.7 -44.59 66.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.667 HD22 ' HB1' ' A' ' 30' ' ' ALA . 85.2 mt -70.91 -36.4 72.69 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 tp -68.86 -43.97 74.3 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 120.717 0.294 . . . . 0.0 110.94 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.7 p -64.02 -30.43 71.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.934 0.397 . . . . 0.0 110.341 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.559 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -60.91 -36.15 78.52 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.579 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.09 -44.89 96.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.876 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 0.8 OUTLIER -70.68 -37.65 73.66 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.161 177.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.616 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 64.7 tttm -64.26 -43.03 96.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.854 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.03 -34.94 77.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.038 0.447 . . . . 0.0 109.974 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -65.43 -44.29 87.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.579 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 53.1 mt-10 -62.44 -33.4 74.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.832 178.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -82.43 -13.5 56.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 74.73 37.16 46.01 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.855 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.6 m -113.1 91.87 19.95 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-O 120.75 0.31 . . . . 0.0 110.328 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 24.3 Cg_exo -64.82 -41.8 17.03 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.017 2.478 . . . . 0.0 113.159 -177.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.29 -43.53 86.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.345 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -37.47 78.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.761 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.49 -42.53 96.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.076 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.42 91.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.018 0.437 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -71.29 -40.14 71.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.559 HD22 ' HB1' ' A' ' 11' ' ' ALA . 67.5 mt -67.63 -33.09 74.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.078 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -64.86 -37.41 87.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.106 0.479 . . . . 0.0 110.404 176.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.0 m -66.75 -39.27 87.86 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.602 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.667 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.35 -38.88 92.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.793 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.87 -43.22 94.84 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.4 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.93 -39.48 69.41 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.254 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.87 -49.85 76.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.785 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.546 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.67 -35.62 78.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -67.64 -39.31 84.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.42 . . . . 0.0 110.484 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -66.25 -32.2 73.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.784 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.09 -14.57 60.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.782 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.539 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.013 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 32.5 Cg_exo -60.45 -44.44 27.49 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.317 2.678 . . . . 0.0 114.256 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.51 -45.69 86.17 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.927 0.394 . . . . 0.0 109.988 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -68.88 -38.33 79.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.572 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -62.19 -45.97 91.02 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.541 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.57 98.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.069 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.19 -47.44 67.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.999 0.428 . . . . 0.0 111.363 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.5 mt -71.83 -37.41 70.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 35.7 tp -69.03 -44.31 72.97 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.376 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 31.4 p -66.15 -32.79 74.45 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.025 0.441 . . . . 0.0 110.324 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.35 96.91 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.635 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -61.04 -40.62 94.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.533 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 47.0 mt-10 -64.89 -39.83 94.14 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.327 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 60.9 tttm -65.94 -35.73 81.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.838 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.549 ' HB2' HD23 ' A' ' 27' ' ' LEU . . . -64.84 -34.68 78.94 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.084 0.469 . . . . 0.0 110.069 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -66.6 -40.81 89.02 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.81 -28.97 70.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.202 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.8 mt -81.52 -16.6 51.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.164 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.71 34.68 42.9 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.936 -0.65 . . . . 0.0 113.168 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.4 p -117.22 91.68 37.61 Favored Pre-proline 0 C--N 1.319 -0.756 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 -43.73 52.53 Favored 'Trans proline' 0 N--CA 1.48 0.715 0 C-N-CA 123.431 2.754 . . . . 0.0 114.848 -175.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 42.2 tt0 -70.44 -44.72 67.26 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.044 -177.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -66.83 -34.63 78.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -62.96 -44.3 96.43 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.977 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.21 99.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.559 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 50.9 mm-40 -68.08 -41.31 82.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.212 0.53 . . . . 0.0 110.301 -179.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 15' ' ' ALA . 9.7 tp -72.82 -33.78 66.41 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.642 -179.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.432 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 13.0 mt -67.33 -33.76 75.93 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 120.805 0.336 . . . . 0.0 110.191 175.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.7 m -63.83 -36.71 84.81 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.62 -40.55 95.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.916 175.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.41 -43.71 96.45 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.065 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 43.5 mt-10 -71.89 -33.12 68.08 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.15 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -63.02 -47.4 83.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.519 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.511 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.915 0.388 . . . . 0.0 110.28 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.17 -45.4 93.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.287 176.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -66.35 -32.64 74.15 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.024 178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -13.98 59.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.619 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.513 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.452 0.168 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.44 -36.25 67.21 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.587 2.191 . . . . 0.0 111.522 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -63.44 -44.94 93.1 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.432 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.12 -42.67 62.66 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.196 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -61.62 -46.08 91.33 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.655 -177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.16 95.42 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.832 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -72.76 -45.76 56.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 111.89 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.725 HD22 ' HB1' ' A' ' 30' ' ' ALA . 95.2 mt -71.54 -36.81 71.1 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.4 tp -69.36 -40.92 77.21 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.4 p -66.74 -33.02 74.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.967 0.413 . . . . 0.0 110.209 178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.634 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.73 -37.37 87.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.994 176.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.11 93.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.995 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 41.7 mt-10 -70.09 -41.86 73.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.397 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.575 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 17.1 tppt? -63.84 -36.6 84.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.92 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.34 -39.43 90.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.051 0.453 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.0 -39.28 79.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 64.5 mm-40 -64.79 -22.81 67.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.646 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 87.1 mt -83.55 -16.25 46.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.688 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.65 20.74 79.74 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.889 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.2 t -109.2 103.54 52.72 Favored Pre-proline 0 C--N 1.32 -0.699 0 O-C-N 122.827 -0.22 . . . . 0.0 110.42 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -38.16 45.38 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.71 2.273 . . . . 0.0 113.082 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.12 -45.05 95.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.841 0.353 . . . . 0.0 110.75 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.52 -33.47 62.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.594 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' HD13 ' A' ' 28' ' ' LEU . 59.6 ttp180 -60.13 -45.3 93.49 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.236 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -41.44 93.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.838 0.351 . . . . 0.0 110.94 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -67.77 -43.26 80.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.14 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.735 HD12 ' HB2' ' A' ' 15' ' ' ALA . 51.1 mt -73.01 -33.04 65.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.738 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 24' ' ' ARG . 8.3 mp -66.12 -31.81 72.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 110.253 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 50.2 m -64.71 -44.08 91.37 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.725 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.58 -40.33 96.67 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.755 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.07 -40.5 89.71 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.134 0.492 . . . . 0.0 110.157 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -70.96 -40.97 71.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.466 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 33.8 mmtp -61.49 -41.14 96.82 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.324 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.711 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.44 -39.83 88.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.952 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -66.42 -42.92 87.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.717 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -62.38 -32.43 73.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.779 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 78.4 mt -77.02 -15.44 59.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.71 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.397 -179.089 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 120.447 0.165 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.85 -34.53 81.97 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.889 2.393 . . . . 0.0 111.242 177.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.64 -44.92 95.05 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.91 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -73.92 -37.7 64.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.942 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.445 ' NH2' ' HA ' ' A' ' 35' ' ' ASP . 42.2 ttm-85 -61.93 -47.22 85.9 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.443 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.62 -44.23 97.38 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -71.39 -45.0 63.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 98.4 mt -71.79 -41.2 68.59 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.71 -39.92 76.59 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -176.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.0 p -64.35 -32.02 73.47 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.939 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.11 -37.78 86.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.549 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.15 99.45 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.06 -41.63 77.32 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.833 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 87.7 tttt -64.67 -41.65 95.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.671 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.413 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.36 -34.93 77.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.657 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -68.25 -41.49 81.07 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.102 0.477 . . . . 0.0 110.045 178.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.42 -33.12 74.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.39 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.3 mt -81.85 -9.12 59.7 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.007 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.552 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.96 36.13 72.89 Favored Glycine 0 N--CA 1.441 -0.985 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.844 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.5 m -106.16 92.92 7.2 Favored Pre-proline 0 C--N 1.321 -0.633 0 C-N-CA 122.138 0.175 . . . . 0.0 110.695 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 23.4 Cg_exo -65.3 -42.35 13.57 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.614 2.209 . . . . 0.0 112.48 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -67.46 -44.28 78.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -72.34 -36.94 68.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -64.26 -36.45 84.14 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.453 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.19 92.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.032 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -71.58 -41.81 68.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.595 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.576 HD22 ' HB1' ' A' ' 11' ' ' ALA . 89.1 mt -68.45 -34.31 75.73 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.743 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -67.81 -34.81 77.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.849 0.357 . . . . 0.0 110.643 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.6 m -66.51 -35.61 80.68 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.89 -41.51 95.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.978 176.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.14 80.09 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.231 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 7.0 tp10 -71.64 -40.91 69.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.146 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.4 ttmt -66.06 -35.85 81.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.09 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.567 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.02 -36.86 82.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.721 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.445 ' HA ' ' NH2' ' A' ' 5' ' ' ARG . 25.0 t70 -65.8 -41.21 92.21 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.538 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 36.3 mt-10 -69.03 -25.73 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.302 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 85.0 mt -81.88 -15.36 54.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.811 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.399 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.401 -179.016 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 33.2 Cg_exo -61.06 -44.42 24.47 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.957 2.438 . . . . 0.0 112.883 -177.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -66.43 -44.57 82.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.86 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.24 -33.85 67.84 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.743 0.306 . . . . 0.0 110.562 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -62.36 -46.1 90.19 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.831 178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.85 -42.96 99.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.429 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.47 -44.14 79.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.608 HD22 ' HB1' ' A' ' 30' ' ' ALA . 50.1 mt -70.52 -36.58 73.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.567 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 tp -67.01 -43.71 82.18 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.703 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.7 p -67.95 -32.16 72.41 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.956 0.407 . . . . 0.0 110.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.49 85.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.013 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.41 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -61.71 -39.14 90.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.834 176.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 40.3 tt0 -70.01 -41.29 74.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.26 177.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -63.65 -43.45 96.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.942 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.427 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.7 -35.03 76.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.936 0.398 . . . . 0.0 110.248 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.28 -41.74 80.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.656 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 29.6 mm-40 -62.26 -33.31 74.38 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.964 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -87.76 -0.46 56.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.412 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.12 36.99 94.2 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.529 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.1 m -105.02 95.07 8.57 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.51 -42.32 21.9 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.818 2.345 . . . . 0.0 113.767 -177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -66.66 -44.56 81.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.053 0.454 . . . . 0.0 110.642 -178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -72.03 -35.82 69.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -62.06 -44.18 97.23 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.647 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.41 -43.7 96.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.119 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -42.52 84.38 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.144 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.484 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.2 mt -69.58 -37.92 77.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.534 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.41 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 25.7 mt -64.37 -36.64 84.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 0.0 110.277 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.455 HG22 ' HE3' ' A' ' 33' ' ' LYS . 50.4 m -70.74 -37.79 73.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.6 177.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.608 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.91 -35.96 81.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.61 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.54 94.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.145 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 47.9 mt-10 -72.24 -39.66 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.873 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 29' ' ' THR . 96.8 mttt -63.32 -40.36 97.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.456 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.01 78.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.368 0.604 . . . . 0.0 109.816 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.66 -39.94 95.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.64 178.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 46.2 mt-10 -62.98 -33.98 76.55 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.241 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.97 -13.84 59.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.003 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.536 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.798 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.074 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 13.0 p . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.496 0.188 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 35.9 Cg_endo -64.57 -44.7 10.48 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.897 2.398 . . . . 0.0 113.422 -177.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.73 -41.3 75.49 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 120.804 0.335 . . . . 0.0 111.109 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.39 -40.9 94.02 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -62.98 -40.75 98.69 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.328 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.57 96.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -69.64 -44.7 70.07 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.066 0.46 . . . . 0.0 111.051 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.632 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.8 mt -71.05 -37.78 72.52 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.05 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 11.6 tp -67.43 -44.26 79.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.034 -178.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -64.02 -37.41 87.31 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.333 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.47 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.92 -38.75 92.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.132 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.27 96.9 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.966 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 46.9 mm-40 -64.62 -40.82 96.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.453 178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.642 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -66.45 -45.66 79.03 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.872 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.79 78.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.79 -38.12 88.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.945 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -71.7 -29.2 64.3 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.64 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 72.5 mt -81.33 -16.28 52.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.639 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.51 26.37 61.32 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.546 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.6 t -103.28 104.42 40.84 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.43 -41.86 30.76 Favored 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.888 2.392 . . . . 0.0 113.445 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.27 -44.83 95.64 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.881 0.372 . . . . 0.0 111.478 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -74.79 -38.98 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.581 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.404 ' HG2' HD12 ' A' ' 28' ' ' LEU . 69.0 ttt-85 -60.13 -44.74 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.269 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.12 82.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.965 0.412 . . . . 0.0 111.186 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -65.85 -41.74 91.31 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.76 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.47 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.7 mt -74.17 -37.4 63.99 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.257 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.404 HD12 ' HG2' ' A' ' 24' ' ' ARG . 19.7 mt -64.5 -40.64 96.02 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.403 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.9 p -69.43 -32.58 71.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.01 0.433 . . . . 0.0 110.322 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.632 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -67.18 -40.88 86.65 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.083 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB1' HD12 ' A' ' 9' ' ' LEU . . . -59.91 -42.97 95.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.232 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -71.7 -33.6 68.93 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.432 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 40.7 ttmt -64.05 -49.81 70.88 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.639 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.64 -34.75 76.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.145 0.498 . . . . 0.0 110.339 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.05 -41.17 99.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.081 177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -66.02 -31.78 72.88 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.44 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.1 mt -75.94 -13.55 60.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.376 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.059 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.883 -179.297 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.668 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 26.0 Cg_exo -63.91 -44.36 13.3 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.019 2.479 . . . . 0.0 112.98 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.36 -43.69 92.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.866 0.365 . . . . 0.0 111.219 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.25 -39.35 65.5 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.372 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -61.77 -43.53 98.68 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.9 -42.95 99.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.232 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -70.97 -44.61 65.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.882 0.372 . . . . 0.0 111.38 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.604 HD22 ' HB1' ' A' ' 30' ' ' ALA . 67.4 mt -70.12 -39.05 75.67 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.157 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.87 -40.58 79.19 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.236 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.402 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 13.8 p -67.32 -34.11 76.68 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.362 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.478 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.66 -39.75 94.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.903 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.97 94.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.963 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 34.0 tt0 -70.56 -41.36 72.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.172 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 10' ' ' THR . 2.3 mptm? -63.92 -44.17 93.71 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.565 0.221 . . . . 0.0 111.068 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.8 78.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.969 0.414 . . . . 0.0 109.961 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.35 -45.6 79.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.231 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 50.3 mt-10 -62.08 -34.73 76.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.627 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -82.29 -7.82 59.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.958 0.408 . . . . 0.0 111.483 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.568 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 76.15 32.43 52.46 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.105 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -101.36 95.64 5.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.568 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 21.9 Cg_exo -65.23 -42.6 13.08 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.87 2.38 . . . . 0.0 113.282 -176.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -69.58 -44.16 71.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.772 0.32 . . . . 0.0 110.868 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.3 -38.95 88.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.223 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -60.57 -45.17 94.93 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.14 94.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.788 0.328 . . . . 0.0 111.267 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -67.79 -40.84 83.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.478 HD22 ' CB ' ' A' ' 11' ' ' ALA . 65.4 mt -70.02 -35.57 74.45 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.145 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.5 mt -66.53 -32.01 73.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.329 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -62.79 -40.89 98.74 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.604 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -70.78 -38.66 73.41 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.228 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.12 94.13 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.689 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -72.83 -37.45 67.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.734 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -68.7 -48.6 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.748 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.19 -34.6 72.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.559 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.83 -42.4 98.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.336 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -63.78 -35.75 81.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.582 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.46 -14.66 59.64 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 120.992 0.425 . . . . 0.0 110.867 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.668 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.433 -1.541 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.652 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.441 0.162 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.541 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.6 Cg_exo -63.86 -44.08 14.28 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.024 2.483 . . . . 0.0 113.488 -177.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.45 -44.5 90.92 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.867 0.365 . . . . 0.0 110.611 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -66.14 -35.67 81.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.037 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.9 -43.86 97.64 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.445 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.05 -42.65 98.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.947 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -69.78 -44.01 70.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 111.441 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 30' ' ' ALA . 86.6 mt -70.44 -39.14 74.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.1 tp -69.1 -41.11 77.9 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.741 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.5 p -64.46 -32.82 74.61 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.596 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.477 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.51 -38.05 89.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.175 176.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -44.3 96.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.828 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -66.63 -39.68 88.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.286 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -68.07 -33.65 74.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.284 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.938 0.399 . . . . 0.0 110.362 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.16 -41.91 85.21 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.6 -34.72 76.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.509 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.63 -17.48 41.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.931 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.89 33.38 65.95 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.072 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 21' ' ' PRO . 4.5 p -105.87 101.25 32.24 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.958 0.379 . . . . 0.0 110.699 179.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 20' ' ' CYS . 30.7 Cg_endo -62.19 -39.99 44.6 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.069 2.513 . . . . 0.0 114.346 -175.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.37 -43.25 86.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.125 0.488 . . . . 0.0 110.624 -177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.52 -38.75 62.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.324 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -59.62 -44.66 93.36 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.02 -178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.65 93.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.008 -179.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -68.82 -42.26 77.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.976 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.477 HD22 ' CB ' ' A' ' 11' ' ' ALA . 66.6 mt -67.1 -34.42 77.59 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.541 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 19.9 mt -67.01 -39.41 87.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.334 176.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.2 m -65.52 -35.17 80.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.069 0.461 . . . . 0.0 109.836 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.16 -39.07 93.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.196 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.92 97.94 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.212 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 37.4 mt-10 -71.95 -39.81 69.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.035 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 88.6 tttt -65.12 -40.54 94.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.13 -35.18 74.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.568 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.13 -44.51 91.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.168 176.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.64 -29.49 69.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.148 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 68.1 mt -78.92 -14.57 59.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.681 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.541 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.446 -0.664 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.294 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.554 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 16.6 m . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.18 -44.22 12.83 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.918 2.412 . . . . 0.0 113.679 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 37.7 tt0 -65.88 -43.79 87.3 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.892 -177.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.554 ' OE1' ' HB3' ' A' ' 1' ' ' SER . 20.0 mp0 -65.19 -39.5 92.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 58.0 ttp180 -62.03 -45.2 94.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.82 99.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.665 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 71.1 mm-40 -63.81 -43.15 97.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.059 0.456 . . . . 0.0 110.74 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.599 HD22 ' HB1' ' A' ' 30' ' ' ALA . 45.7 mt -70.5 -40.38 73.59 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.372 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -68.7 -40.08 80.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.472 -178.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 6.2 p -64.41 -37.35 87.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.861 0.362 . . . . 0.0 110.114 177.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.504 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.83 -36.97 84.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.425 177.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.32 -40.75 91.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.567 177.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -68.79 -41.26 78.97 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.394 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.606 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 29.2 mtpp -64.22 -44.69 91.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.323 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.9 -37.12 86.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.993 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.57 -44.2 78.76 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.959 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.15 -31.78 72.3 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.522 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 54.3 mt -82.76 -9.34 59.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.22 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.71 39.69 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.755 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 m -114.48 92.04 26.82 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.784 0.326 . . . . 0.0 110.743 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.84 -42.19 15.77 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.118 2.545 . . . . 0.0 113.118 -177.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 11.3 mp0 -62.43 -43.79 97.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.728 0.299 . . . . 0.0 110.678 -178.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.89 -39.54 79.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.042 0.449 . . . . 0.0 110.138 178.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -60.07 -43.6 95.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.665 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.12 88.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.408 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 58.6 mm-40 -72.12 -37.09 69.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.09 0.472 . . . . 0.0 110.899 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.504 HD22 ' CB ' ' A' ' 11' ' ' ALA . 43.8 mt -73.27 -36.21 66.31 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.072 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 32.3 mt -67.21 -39.5 86.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.206 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.2 p -70.98 -32.82 69.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.153 0.502 . . . . 0.0 110.388 178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.599 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.19 -40.43 97.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.287 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -40.57 88.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.409 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.65 -39.79 80.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.244 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -68.43 -40.88 81.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.655 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.84 -35.26 79.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.476 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.44 -36.97 84.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.312 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.53 -33.05 74.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.158 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.9 -14.29 59.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.818 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.022 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.617 -178.232 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 CA--C 1.54 0.573 0 CA-C-O 120.591 0.234 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.3 Cg_exo -63.82 -45.33 11.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.148 2.565 . . . . 0.0 113.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.27 -44.22 88.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.467 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -66.29 -39.71 89.55 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.962 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -64.33 -39.51 94.05 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.146 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.71 -42.59 93.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.827 0.346 . . . . 0.0 111.322 -177.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -69.57 -44.13 71.47 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.694 HD22 ' HB1' ' A' ' 30' ' ' ALA . 88.8 mt -70.4 -37.7 74.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.281 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.3 tp -68.9 -39.71 79.55 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -67.48 -32.49 73.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.919 0.39 . . . . 0.0 110.303 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.81 -40.42 97.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.87 175.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.857 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -64.72 -41.21 96.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.161 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.401 ' O ' HD23 ' A' ' 18' ' ' LEU . 84.5 tttt -64.51 -45.82 85.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.994 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -65.99 -34.96 79.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -68.39 -38.95 81.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.01 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -66.95 -35.26 79.57 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.83 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.401 HD23 ' O ' ' A' ' 14' ' ' LYS . 4.1 mm? -81.03 -11.76 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.3 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.74 24.84 73.49 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.919 178.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.6 t -95.27 101.98 8.66 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.14 -43.0 12.23 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.806 2.337 . . . . 0.0 114.532 -173.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -71.36 -43.3 67.19 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.442 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.74 -35.06 78.06 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.277 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HG2' HD12 ' A' ' 28' ' ' LEU . 57.5 ttp180 -61.54 -43.97 97.9 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.122 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -43.62 98.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.776 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -65.92 -43.02 89.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.775 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 11' ' ' ALA . 83.5 mt -73.28 -35.85 66.22 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.844 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.453 HD12 ' HG2' ' A' ' 24' ' ' ARG . 15.5 mt -67.58 -33.61 75.37 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.755 0.312 . . . . 0.0 110.511 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.9 m -63.82 -40.83 97.55 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.694 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -66.67 -39.84 88.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.628 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -43.82 95.35 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.246 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 64.5 mm-40 -73.09 -39.68 65.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.156 177.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.627 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.7 tptt -54.54 -55.69 26.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.953 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.87 -34.55 74.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.099 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.02 -42.33 97.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.113 177.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 57.5 mm-40 -65.67 -34.17 77.59 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.319 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 73.3 mt -76.67 -14.8 59.94 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.583 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.489 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.445 -0.728 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.59 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.739 0.304 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -63.94 -34.84 58.22 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.057 2.505 . . . . 0.0 112.09 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.08 -44.38 89.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.182 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -70.53 -33.9 71.68 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.66 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -62.37 -42.06 99.1 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.706 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.44 -42.92 99.5 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.923 0.392 . . . . 0.0 110.867 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.75 -40.6 88.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.211 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.546 HD22 ' HB1' ' A' ' 30' ' ' ALA . 53.1 mt -69.83 -37.94 76.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.445 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -65.39 -41.22 93.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.243 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -72.0 -32.18 66.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.939 0.4 . . . . 0.0 110.229 177.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.496 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.38 -37.76 86.98 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.436 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -60.76 -43.82 97.53 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.726 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.91 -33.88 72.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.339 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -65.13 -46.11 82.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.869 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.79 -36.32 83.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.957 0.408 . . . . 0.0 110.799 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.14 -41.24 94.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.863 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.09 -34.49 78.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.866 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.09 -11.84 58.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.03 34.79 29.24 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.046 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.1 m -111.19 90.82 12.2 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.04 -42.04 15.25 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.788 2.325 . . . . 0.0 113.353 -176.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.7 -43.14 80.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.607 0.241 . . . . 0.0 110.795 -177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.72 -38.62 87.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.51 -44.88 95.56 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.673 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.87 90.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.268 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -69.28 -40.94 77.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.496 HD22 ' HB1' ' A' ' 11' ' ' ALA . 61.8 mt -68.58 -33.52 74.2 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.155 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.434 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 44.5 mt -66.32 -42.98 87.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.22 177.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.3 p -65.69 -31.78 72.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.86 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.9 -34.38 77.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.9 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.67 92.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.857 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.6 -40.29 66.64 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.972 0.415 . . . . 0.0 111.019 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.604 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 61.3 mmtt -65.12 -35.04 79.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.919 -178.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.24 -35.57 79.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.686 0.279 . . . . 0.0 110.901 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -67.65 -42.49 82.15 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.02 -33.36 75.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.678 177.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.6 mt -76.92 -14.46 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.87 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.47 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.542 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 25.7 Cg_exo -63.09 -41.96 25.7 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.081 2.52 . . . . 0.0 113.556 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.72 -46.15 69.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.767 0.318 . . . . 0.0 111.15 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.8 -34.0 73.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.542 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.55 ' HG2' HD12 ' A' ' 9' ' ' LEU . 43.7 ttt180 -62.72 -45.33 93.23 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.739 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.68 -42.21 98.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.798 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -63.38 -44.48 94.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.852 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.547 HD22 ' HB1' ' A' ' 30' ' ' ALA . 55.8 mt -70.03 -40.6 75.07 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.614 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.55 HD12 ' HG2' ' A' ' 5' ' ' ARG . 13.6 mt -67.08 -36.08 81.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.984 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 14.2 p -71.99 -36.77 69.85 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.94 177.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.54 -37.35 85.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.164 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -60.71 -42.32 97.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.724 176.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -69.75 -41.07 75.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.286 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 32.4 mmtp -66.24 -40.55 90.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.597 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.07 -35.09 79.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.409 . . . . 0.0 110.384 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.85 -40.77 88.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.888 177.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -65.12 -28.39 69.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.325 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 85.0 mt -82.24 -11.18 58.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.718 178.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.76 50.08 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.724 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -114.54 91.84 26.34 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.33 -39.82 27.91 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.843 2.362 . . . . 0.0 112.802 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 33.0 tt0 -67.12 -43.17 83.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.723 0.297 . . . . 0.0 110.505 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -64.49 -42.2 96.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 56.3 ttt180 -60.73 -43.03 98.41 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.461 178.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.95 97.59 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.063 0.459 . . . . 0.0 111.155 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 90.6 mt-30 -65.73 -41.14 92.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.487 HD22 ' CB ' ' A' ' 11' ' ' ALA . 37.6 mt -73.54 -36.18 65.64 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.739 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.3 mt -66.73 -37.48 84.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.416 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -70.94 -31.85 68.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.158 0.504 . . . . 0.0 110.082 177.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.547 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.61 -35.2 80.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.21 82.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.72 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -69.49 -40.38 77.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.892 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -61.69 -49.23 77.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.837 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.455 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.12 -35.27 80.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.407 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.17 -46.67 87.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.514 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.91 -27.13 67.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.14 0.495 . . . . 0.0 110.321 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -76.77 -14.65 59.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.896 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.542 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.617 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.909 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.77 -42.34 20.52 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.888 2.392 . . . . 0.0 113.892 -175.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -67.66 -46.11 73.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.021 0.439 . . . . 0.0 111.264 -177.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.13 -32.83 71.01 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.819 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.48 ' HG2' HD12 ' A' ' 9' ' ' LEU . 63.9 ttt-85 -61.5 -46.2 91.01 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.955 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.6 -43.24 94.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.59 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -66.35 -42.83 87.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.687 0.28 . . . . 0.0 111.682 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.523 HD22 ' HB1' ' A' ' 30' ' ' ALA . 68.5 mt -69.63 -38.31 77.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.727 0.298 . . . . 0.0 111.514 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.544 ' HG ' ' HB1' ' A' ' 31' ' ' ALA . 11.6 mt -67.45 -38.85 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.867 178.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -72.0 -32.81 67.55 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.577 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.485 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.39 -37.33 85.31 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.827 176.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.496 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.86 -44.55 96.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.285 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.12 -40.61 71.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.109 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.34 -37.2 86.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.537 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -37.98 88.63 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.479 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.61 -41.6 96.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.78 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.22 -34.79 75.69 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.612 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.3 tp -90.06 0.14 57.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.284 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.64 -92.99 1.51 Allowed Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -177.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' GLU . 36.1 m 25.32 70.18 0.39 Allowed Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.116 1.366 . . . . 0.0 113.769 175.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.3 -41.86 46.82 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.407 2.071 . . . . 0.0 112.78 -177.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.24 -44.23 63.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.917 0.389 . . . . 0.0 111.283 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 20' ' ' CYS . 31.5 mt-10 -66.08 -34.86 79.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.152 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 67.3 ttt180 -61.03 -43.47 98.84 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.184 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.25 95.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.566 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.29 -41.9 99.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.658 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.485 HD22 ' CB ' ' A' ' 11' ' ' ALA . 48.2 mt -68.92 -38.35 79.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.055 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.496 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 37.1 mt -65.69 -32.51 74.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 176.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.0 m -68.04 -40.28 82.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.731 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.523 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.18 -35.76 81.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.685 177.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HG ' ' A' ' 9' ' ' LEU . . . -59.27 -43.27 92.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.861 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -72.69 -39.45 67.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 ttmt -63.12 -45.64 91.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.897 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.04 -34.94 79.62 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.049 0.452 . . . . 0.0 110.225 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.28 -43.72 97.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.409 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.99 -30.53 71.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.971 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.3 mt -76.91 -13.41 59.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.991 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.007 0 C-N-CA 120.688 -0.767 . . . . 0.0 111.823 -178.561 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -58.84 -44.31 36.85 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.133 2.555 . . . . 0.0 113.638 -177.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -64.59 -42.93 95.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.842 0.354 . . . . 0.0 111.41 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -73.38 -34.3 65.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.274 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -62.34 -45.1 94.73 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.992 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.77 99.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.274 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -68.66 -44.88 73.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.923 -179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.645 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.7 mt -70.52 -36.42 73.73 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.916 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.1 tp -68.85 -40.79 79.15 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.944 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.5 p -68.19 -32.8 73.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.122 0.487 . . . . 0.0 110.043 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.525 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.63 -37.23 85.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.86 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.91 94.09 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.545 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 31.2 mt-10 -70.25 -34.45 72.85 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.079 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.476 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 55.2 mttp -63.5 -44.8 93.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.593 0.235 . . . . 0.0 110.915 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.55 78.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.123 0.487 . . . . 0.0 109.798 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -64.03 -42.65 97.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.574 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 24.2 mm-40 -62.01 -34.32 75.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.836 177.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -81.55 -15.97 53.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.798 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.37 33.31 48.95 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.793 179.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -113.82 97.79 45.57 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.046 0.451 . . . . 0.0 110.944 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.14 -37.04 86.49 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 123.123 2.549 . . . . 0.0 113.341 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.54 -46.0 90.38 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.779 0.323 . . . . 0.0 111.204 -176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -76.43 -35.3 58.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.862 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -60.75 -43.25 98.21 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.322 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.71 95.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.651 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -65.37 -42.89 92.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.525 HD22 ' HB1' ' A' ' 11' ' ' ALA . 60.2 mt -71.38 -35.78 71.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.654 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.1 mt -66.16 -34.4 77.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.922 0.391 . . . . 0.0 110.414 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.5 m -64.78 -36.84 85.61 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.419 0.628 . . . . 0.0 109.361 176.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.645 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -69.45 -38.68 77.91 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.641 178.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.49 93.75 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.903 177.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -70.75 -40.48 72.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.625 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -64.72 -43.19 94.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.015 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.62 -35.14 79.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.457 . . . . 0.0 110.434 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.06 -42.87 84.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.258 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -63.47 -35.4 80.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.036 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 37' ' ' LEU . 1.9 tm? -77.1 -14.89 59.74 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.221 0.534 . . . . 0.0 110.13 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.824 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.92 -179.474 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 110.555 -0.165 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.1 Cg_exo -64.14 -45.07 10.74 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.797 2.332 . . . . 0.0 113.019 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 59.2 mm-40 -68.22 -42.94 79.04 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.709 0.29 . . . . 0.0 111.145 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -66.01 -39.68 90.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.426 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -62.24 -43.49 98.71 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.323 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.87 -42.91 98.83 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.121 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.8 mm100 -70.01 -44.39 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.939 0.399 . . . . 0.0 111.379 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.62 HD22 ' HB1' ' A' ' 30' ' ' ALA . 79.2 mt -71.09 -38.31 72.41 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.34 -178.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.38 -44.01 79.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 120.644 0.259 . . . . 0.0 111.066 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.8 p -67.15 -32.66 73.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.5 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.41 -37.41 85.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.248 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.466 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.56 -39.22 87.18 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.791 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.54 -39.68 73.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.269 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -64.61 -45.14 88.17 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.912 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.78 -36.32 80.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.924 0.393 . . . . 0.0 110.814 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.81 -44.76 84.71 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.192 0.52 . . . . 0.0 109.615 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.22 -31.68 72.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.056 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 95.3 mt -82.46 -16.01 50.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.518 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.98 29.86 27.48 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.227 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.5 m -102.72 97.84 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.77 -43.86 9.03 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.36 2.04 . . . . 0.0 113.435 -176.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.52 -42.92 64.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.029 0.442 . . . . 0.0 110.594 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.78 -34.26 77.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.017 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -59.91 -44.73 94.12 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -39.26 77.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.941 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -63.26 -42.49 99.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.095 0.474 . . . . 0.0 110.556 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.515 HD12 ' HB2' ' A' ' 15' ' ' ALA . 57.6 mt -75.3 -35.84 61.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.922 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 18.5 mt -64.18 -39.35 93.8 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 p -70.96 -34.63 71.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.944 0.402 . . . . 0.0 110.075 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.62 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.76 -35.82 81.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.447 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.95 90.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.76 177.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -71.66 -40.12 69.86 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.905 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 65.2 mttm -57.19 -54.8 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.426 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.83 -35.89 79.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.89 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.05 -42.36 89.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.405 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.94 -33.59 76.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.169 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.8 mt -79.41 -14.45 58.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.386 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.571 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.781 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.207 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 68.6 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 30.7 Cg_endo -63.36 -38.38 43.75 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.97 2.447 . . . . 0.0 112.787 -177.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -69.45 -44.04 72.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 0.0 110.282 -178.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -66.63 -36.68 83.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.805 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.494 ' HD3' ' OD1' ' A' ' 35' ' ' ASP . 8.8 ttm180 -61.68 -46.44 89.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.642 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.92 -39.91 91.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.19 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -64.86 -45.75 84.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.723 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.734 HD23 ' HB2' ' A' ' 34' ' ' ALA . 0.5 OUTLIER -71.66 -43.77 65.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.472 HD13 ' HG2' ' A' ' 5' ' ' ARG . 10.5 mp -62.35 -37.85 87.27 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.412 -178.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 21.9 p -72.09 -32.45 67.03 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.274 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.63 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.46 85.75 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.612 177.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.85 97.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.603 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.17 -37.2 78.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.395 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 68.5 mttm -64.75 -36.44 84.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.634 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -66.22 -35.38 80.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.984 177.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.29 -43.14 99.37 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.809 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -67.25 -34.76 78.14 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.756 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 76.8 mt -81.88 -17.59 46.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.096 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.403 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.84 28.82 71.5 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 113.016 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 23' ' ' GLU . 4.0 p -105.14 102.17 34.77 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.906 0.384 . . . . 0.0 111.168 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 43.0 Cg_exo -57.78 -41.71 67.03 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.264 2.643 . . . . 0.0 113.62 -177.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.86 -44.81 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.334 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 34.7 mt-10 -69.63 -36.13 75.85 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.975 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -60.97 -44.37 97.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.77 97.9 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.87 0.367 . . . . 0.0 111.181 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.85 -41.13 71.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.235 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.63 HD22 ' HB1' ' A' ' 11' ' ' ALA . 78.2 mt -67.39 -34.34 77.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.717 0.294 . . . . 0.0 111.091 178.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.2 mt -69.49 -32.49 71.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.545 175.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.8 m -67.75 -43.95 78.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.506 ' HB1' ' HG ' ' A' ' 8' ' ' LEU . . . -63.31 -39.27 94.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.351 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.593 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . . . -62.03 -44.53 96.5 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.158 0.504 . . . . 0.0 110.42 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 5.7 tp10 -67.29 -39.5 85.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.01 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -66.28 -41.02 90.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.216 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.734 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -62.25 -36.73 82.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.317 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' OD1' ' HD3' ' A' ' 5' ' ' ARG . 4.5 m-20 -60.87 -41.88 96.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.734 176.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 38.0 mt-10 -70.38 -33.48 71.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.375 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.85 -14.23 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.738 0.304 . . . . 0.0 111.255 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.436 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.385 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -61.48 -44.36 22.92 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.038 2.492 . . . . 0.0 114.227 -173.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.82 -45.11 75.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.025 0.441 . . . . 0.0 110.461 -177.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.78 -34.96 76.44 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.516 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.515 ' O ' HD23 ' A' ' 9' ' ' LEU . 35.6 ttp180 -62.53 -47.75 82.52 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.994 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.85 95.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.137 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -68.97 -45.28 71.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.563 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 30' ' ' ALA . 58.9 mt -70.63 -41.67 71.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 5' ' ' ARG . 4.2 mm? -63.0 -42.55 99.88 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-O 120.769 0.319 . . . . 0.0 111.03 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.9 p -70.1 -35.17 73.96 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.189 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.466 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.45 -38.94 91.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.246 177.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -43.85 98.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.281 0.562 . . . . 0.0 109.502 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 13.9 mm-40 -68.02 -40.8 82.85 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.372 179.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 96.5 mttt -67.81 -37.63 82.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.412 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.1 -35.15 79.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.138 0.495 . . . . 0.0 109.945 176.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.42 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 16.3 t70 -63.76 -44.65 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.374 175.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 96.3 mt-10 -65.75 -28.77 69.28 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.333 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 47.7 mt -82.84 -11.78 57.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.855 0.36 . . . . 0.0 111.086 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.36 50.38 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.363 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.5 m -116.28 89.07 25.03 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.59 -37.13 38.93 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.703 2.269 . . . . 0.0 112.73 -177.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -64.57 -43.88 92.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.568 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -73.59 -34.64 65.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.311 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -60.02 -43.91 94.96 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.423 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.887 0.375 . . . . 0.0 110.836 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.83 -40.13 94.69 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.338 0.589 . . . . 0.0 110.308 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.466 HD22 ' CB ' ' A' ' 11' ' ' ALA . 45.0 mt -74.7 -34.64 62.67 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.198 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.3 mt -65.27 -42.4 93.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.301 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 p -64.22 -36.1 82.98 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.25 0.548 . . . . 0.0 109.941 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.489 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -69.3 -40.41 77.71 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.315 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 9' ' ' LEU . . . -60.59 -43.73 97.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.727 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -66.34 -40.03 89.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.892 -178.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -73.11 -35.11 66.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.483 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -64.42 -38.06 89.69 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.834 0.35 . . . . 0.0 110.971 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -63.21 -47.51 82.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.801 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.0 -21.18 61.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.949 0.404 . . . . 0.0 111.112 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.26 -15.69 59.96 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.279 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.578 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.721 179.277 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 120.948 0.404 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -57.39 -34.62 98.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.945 2.43 . . . . 0.0 112.83 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.15 -44.01 93.45 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.862 0.363 . . . . 0.0 110.853 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -72.27 -35.68 68.81 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.439 ' HA ' ' CB ' ' A' ' 34' ' ' ALA . 56.3 ttp180 -62.38 -46.18 89.8 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.897 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.01 97.85 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.91 0.386 . . . . 0.0 110.892 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -67.59 -46.08 73.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.282 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.666 HD12 ' HB2' ' A' ' 34' ' ' ALA . 65.8 mt -72.26 -40.41 67.68 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.53 -41.92 88.01 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 15.6 p -64.11 -38.12 89.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.371 . . . . 0.0 110.297 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.439 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.23 -38.67 91.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.168 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.475 ' HB1' HD23 ' A' ' 28' ' ' LEU . . . -62.13 -42.67 99.47 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.935 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.82 -41.35 91.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.569 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 10' ' ' THR . 97.5 mttt -63.85 -44.43 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.68 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.36 -43.52 85.79 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.948 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' HD2' ' A' ' 24' ' ' ARG . 17.9 t70 -59.17 -42.99 92.09 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.019 0.438 . . . . 0.0 110.963 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.97 -35.07 77.4 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.523 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.2 tp -93.31 -17.0 24.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.95 0.405 . . . . 0.0 111.551 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.19 -99.91 1.57 Allowed Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.0 m 42.21 79.68 0.32 Allowed Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 123.543 0.737 . . . . 0.0 111.801 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.56 -43.87 53.94 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 122.736 2.291 . . . . 0.0 113.896 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -74.11 -43.45 57.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.88 0.372 . . . . 0.0 111.633 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.24 -43.24 74.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.502 -177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.417 ' HD2' ' OD1' ' A' ' 16' ' ' ASP . 9.5 ttp180 -62.18 -44.37 96.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.635 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.91 96.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.574 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -73.18 -38.89 65.99 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.941 -178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.439 HD22 ' CB ' ' A' ' 11' ' ' ALA . 70.7 mt -70.73 -38.32 73.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.702 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.475 HD23 ' HB1' ' A' ' 12' ' ' ALA . 29.0 mt -67.08 -39.63 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.664 0.269 . . . . 0.0 111.36 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -71.0 -33.22 70.19 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.865 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.19 -36.04 82.78 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.372 176.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.22 96.02 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.847 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -71.97 -40.33 68.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.899 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 69.1 mmtt -66.91 -36.45 82.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.545 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.21 -41.6 99.17 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.155 0.502 . . . . 0.0 110.387 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.56 -38.12 83.67 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.553 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.44 -33.62 74.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.491 177.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 95.6 mt -76.68 -15.48 59.78 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.126 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.004 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.787 -179.804 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.445 -0.713 0 CA-C-O 120.68 0.276 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.18 -40.67 31.7 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.968 2.445 . . . . 0.0 113.493 -177.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 13.8 tp10 -64.3 -44.89 90.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.14 0.495 . . . . 0.0 109.888 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -65.96 -41.78 90.79 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.25 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.9 ttm105 -61.87 -46.86 87.6 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.409 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.62 93.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 79.4 mm-40 -70.04 -44.8 68.47 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.732 HD12 ' HB2' ' A' ' 34' ' ' ALA . 75.5 mt -71.21 -37.12 72.1 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.5 tp -69.28 -42.93 74.84 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 120.587 0.232 . . . . 0.0 111.387 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -64.98 -32.83 74.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.705 0.288 . . . . 0.0 110.89 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.92 -42.62 97.33 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.164 0.506 . . . . 0.0 109.642 176.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -62.13 -44.21 97.13 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.385 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -66.4 -41.09 89.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -65.37 -44.34 87.9 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.08 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.02 85.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -59.57 -37.54 78.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.116 0.484 . . . . 0.0 111.075 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -61.35 -34.71 75.74 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.856 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -93.33 -0.53 56.62 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.707 0.765 . . . . 0.0 110.163 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.84 -101.19 2.68 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.7 m 38.47 70.75 1.22 Allowed Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 123.594 0.758 . . . . 0.0 111.615 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HG2' ' A' ' 24' ' ' ARG . 44.8 Cg_exo -55.66 -42.92 62.7 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.578 2.185 . . . . 0.0 113.579 -174.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -72.24 -38.2 68.98 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.457 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -72.39 -43.54 63.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.369 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.441 ' HG2' ' HA ' ' A' ' 21' ' ' PRO . 38.2 ptt180 -64.31 -36.59 84.61 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.117 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.71 -44.42 96.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 111.267 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.51 -39.35 74.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.662 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 11' ' ' ALA . 64.8 mt -67.84 -39.54 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.063 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 26.5 mt -64.4 -36.99 85.94 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.834 177.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.636 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 87.6 m -63.57 -41.96 98.35 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 176.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.668 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.68 -36.07 81.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.384 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.95 95.88 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.9 176.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 36.8 mt-10 -70.55 -40.27 73.49 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.63 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 29' ' ' THR . 30.4 mmmt -64.11 -42.73 96.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.925 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.732 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.62 -35.88 77.24 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.817 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.42 -38.41 84.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.585 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.19 -26.6 67.48 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.19 0.519 . . . . 0.0 110.615 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 70.8 mt -77.3 -14.54 59.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.34 177.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.631 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.45 -0.447 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 48.1 Cg_exo -57.71 -44.03 44.78 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.185 2.59 . . . . 0.0 113.543 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 7' ' ' GLN . 44.4 mt-10 -61.52 -45.22 95.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.001 -178.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.94 -33.66 64.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.804 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -62.58 -44.39 96.43 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.51 98.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.835 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 3' ' ' GLU . 92.0 mt-30 -68.84 -46.48 68.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.0 111.015 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.619 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.3 mt -71.78 -39.62 69.82 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 58.3 tp -67.61 -41.92 83.21 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 120.534 0.207 . . . . 0.0 111.223 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.9 p -67.73 -33.08 74.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.078 0.466 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.478 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -66.23 -38.46 87.95 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.935 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -42.91 99.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.242 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 49.2 mt-10 -64.83 -41.51 95.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -66.47 -36.4 82.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.516 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.41 -38.39 86.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.079 0.466 . . . . 0.0 110.461 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.28 -44.42 75.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.052 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 52.5 mt-10 -67.53 -34.86 77.94 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.824 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.4 tp -82.81 -17.33 44.43 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.025 0.44 . . . . 0.0 110.46 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.35 32.18 62.7 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.711 176.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.2 m -92.5 105.52 14.68 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 116.86 0.33 . . . . 0.0 110.48 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 30.3 Cg_endo -64.09 -42.07 20.02 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.631 2.22 . . . . 0.0 113.369 -177.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.6 -43.69 75.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.137 0.494 . . . . 0.0 110.454 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -73.21 -38.79 65.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.823 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 21' ' ' PRO . 13.1 ptm180 -61.18 -38.62 87.16 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.0 96.07 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.947 0.403 . . . . 0.0 110.898 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -74.6 -40.93 61.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.235 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 15' ' ' ALA . 78.8 mt -72.43 -41.2 66.44 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -176.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.83 -42.09 90.98 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.767 -0.373 . . . . 0.0 111.213 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 p -67.23 -37.45 83.59 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 110.29 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.619 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.44 -39.1 93.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.002 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.57 93.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.675 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.93 -33.51 61.99 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.958 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 55.4 tptt -66.25 -42.3 88.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.721 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.607 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.26 -35.93 78.63 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.488 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.54 -39.86 85.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.167 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -63.07 -33.08 74.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.584 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.7 mt -78.09 -14.88 59.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.673 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.441 -1.017 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.753 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 120.488 0.185 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.539 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.9 Cg_exo -63.92 -37.89 41.48 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.027 2.484 . . . . 0.0 113.387 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.73 -44.76 92.62 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.95 0.405 . . . . 0.0 110.52 -178.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -68.82 -41.44 78.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.28 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -62.27 -46.33 89.28 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.475 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.77 98.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.787 0.327 . . . . 0.0 111.421 -178.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.7 -44.59 66.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.667 HD22 ' HB1' ' A' ' 30' ' ' ALA . 85.2 mt -70.91 -36.4 72.69 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 tp -68.86 -43.97 74.3 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 120.717 0.294 . . . . 0.0 110.94 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.7 p -64.02 -30.43 71.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.934 0.397 . . . . 0.0 110.341 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.559 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -60.91 -36.15 78.52 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.579 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.09 -44.89 96.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.876 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 0.8 OUTLIER -70.68 -37.65 73.66 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.161 177.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.616 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 64.7 tttm -64.26 -43.03 96.12 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.854 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.03 -34.94 77.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.038 0.447 . . . . 0.0 109.974 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -65.43 -44.29 87.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.579 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 53.1 mt-10 -62.44 -33.4 74.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.832 178.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -82.43 -13.5 56.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 74.73 37.16 46.01 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.855 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.6 m -113.1 91.87 19.95 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-O 120.75 0.31 . . . . 0.0 110.328 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 24.3 Cg_exo -64.82 -41.8 17.03 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.017 2.478 . . . . 0.0 113.159 -177.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.29 -43.53 86.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.345 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -37.47 78.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.761 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.49 -42.53 96.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.076 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.42 91.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.018 0.437 . . . . 0.0 110.794 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -71.29 -40.14 71.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.559 HD22 ' HB1' ' A' ' 11' ' ' ALA . 67.5 mt -67.63 -33.09 74.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.078 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -64.86 -37.41 87.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.106 0.479 . . . . 0.0 110.404 176.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.0 m -66.75 -39.27 87.86 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.602 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.667 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.35 -38.88 92.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.793 178.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.87 -43.22 94.84 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.4 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.93 -39.48 69.41 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.254 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.87 -49.85 76.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.785 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.546 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.67 -35.62 78.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -67.64 -39.31 84.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.42 . . . . 0.0 110.484 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -66.25 -32.2 73.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.784 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.09 -14.57 60.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.782 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.539 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.449 -0.437 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.013 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 32.5 Cg_exo -60.45 -44.44 27.49 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.317 2.678 . . . . 0.0 114.256 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.51 -45.69 86.17 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.927 0.394 . . . . 0.0 109.988 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -68.88 -38.33 79.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.572 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -62.19 -45.97 91.02 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.541 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.57 98.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.069 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.19 -47.44 67.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.999 0.428 . . . . 0.0 111.363 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.5 mt -71.83 -37.41 70.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 35.7 tp -69.03 -44.31 72.97 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.376 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 31.4 p -66.15 -32.79 74.45 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.025 0.441 . . . . 0.0 110.324 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.35 96.91 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.635 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -61.04 -40.62 94.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.533 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 47.0 mt-10 -64.89 -39.83 94.14 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.327 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 60.9 tttm -65.94 -35.73 81.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.838 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.549 ' HB2' HD23 ' A' ' 27' ' ' LEU . . . -64.84 -34.68 78.94 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.084 0.469 . . . . 0.0 110.069 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -66.6 -40.81 89.02 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 176.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.81 -28.97 70.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.202 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.8 mt -81.52 -16.6 51.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.164 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.71 34.68 42.9 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.936 -0.65 . . . . 0.0 113.168 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.4 p -117.22 91.68 37.61 Favored Pre-proline 0 C--N 1.319 -0.756 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 -43.73 52.53 Favored 'Trans proline' 0 N--CA 1.48 0.715 0 C-N-CA 123.431 2.754 . . . . 0.0 114.848 -175.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 42.2 tt0 -70.44 -44.72 67.26 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.044 -177.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -66.83 -34.63 78.22 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -62.96 -44.3 96.43 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.977 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.21 99.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.559 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 50.9 mm-40 -68.08 -41.31 82.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.212 0.53 . . . . 0.0 110.301 -179.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 15' ' ' ALA . 9.7 tp -72.82 -33.78 66.41 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.642 -179.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.432 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 13.0 mt -67.33 -33.76 75.93 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 120.805 0.336 . . . . 0.0 110.191 175.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.7 m -63.83 -36.71 84.81 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.62 -40.55 95.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.916 175.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.41 -43.71 96.45 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.065 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 43.5 mt-10 -71.89 -33.12 68.08 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.15 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -63.02 -47.4 83.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.519 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.511 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.915 0.388 . . . . 0.0 110.28 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.17 -45.4 93.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.287 176.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -66.35 -32.64 74.15 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.024 178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -13.98 59.92 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.619 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.513 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.452 0.168 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.44 -36.25 67.21 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.587 2.191 . . . . 0.0 111.522 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -63.44 -44.94 93.1 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.432 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.12 -42.67 62.66 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.196 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -61.62 -46.08 91.33 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.655 -177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.16 95.42 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.832 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -72.76 -45.76 56.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 111.89 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.725 HD22 ' HB1' ' A' ' 30' ' ' ALA . 95.2 mt -71.54 -36.81 71.1 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.4 tp -69.36 -40.92 77.21 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.4 p -66.74 -33.02 74.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.967 0.413 . . . . 0.0 110.209 178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.634 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.73 -37.37 87.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.994 176.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.11 93.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.995 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 41.7 mt-10 -70.09 -41.86 73.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.397 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.575 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 17.1 tppt? -63.84 -36.6 84.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.92 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.34 -39.43 90.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.051 0.453 . . . . 0.0 110.723 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.0 -39.28 79.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 64.5 mm-40 -64.79 -22.81 67.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.646 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 87.1 mt -83.55 -16.25 46.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.688 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.65 20.74 79.74 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.889 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.2 t -109.2 103.54 52.72 Favored Pre-proline 0 C--N 1.32 -0.699 0 O-C-N 122.827 -0.22 . . . . 0.0 110.42 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -38.16 45.38 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.71 2.273 . . . . 0.0 113.082 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.12 -45.05 95.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.841 0.353 . . . . 0.0 110.75 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -74.52 -33.47 62.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.594 178.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.505 ' O ' HD13 ' A' ' 28' ' ' LEU . 59.6 ttp180 -60.13 -45.3 93.49 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.236 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -41.44 93.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.838 0.351 . . . . 0.0 110.94 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -67.77 -43.26 80.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.14 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.735 HD12 ' HB2' ' A' ' 15' ' ' ALA . 51.1 mt -73.01 -33.04 65.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.738 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 24' ' ' ARG . 8.3 mp -66.12 -31.81 72.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 110.253 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 50.2 m -64.71 -44.08 91.37 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.725 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.58 -40.33 96.67 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.755 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.07 -40.5 89.71 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.134 0.492 . . . . 0.0 110.157 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -70.96 -40.97 71.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.466 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 33.8 mmtp -61.49 -41.14 96.82 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.324 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.711 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.44 -39.83 88.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.952 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -66.42 -42.92 87.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.717 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -62.38 -32.43 73.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.779 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 78.4 mt -77.02 -15.44 59.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.71 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.397 -179.089 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 120.447 0.165 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -61.85 -34.53 81.97 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.889 2.393 . . . . 0.0 111.242 177.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.64 -44.92 95.05 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.91 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -73.92 -37.7 64.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.942 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.445 ' NH2' ' HA ' ' A' ' 35' ' ' ASP . 42.2 ttm-85 -61.93 -47.22 85.9 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.443 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.62 -44.23 97.38 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -71.39 -45.0 63.9 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.655 HD22 ' HB1' ' A' ' 30' ' ' ALA . 98.4 mt -71.79 -41.2 68.59 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.71 -39.92 76.59 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -176.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.0 p -64.35 -32.02 73.47 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.939 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.11 -37.78 86.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.549 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.15 99.45 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.06 -41.63 77.32 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.833 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 87.7 tttt -64.67 -41.65 95.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.671 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.413 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -62.36 -34.93 77.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.657 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -68.25 -41.49 81.07 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.102 0.477 . . . . 0.0 110.045 178.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.42 -33.12 74.17 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.39 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 78.3 mt -81.85 -9.12 59.7 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.007 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.552 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.96 36.13 72.89 Favored Glycine 0 N--CA 1.441 -0.985 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.844 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.5 m -106.16 92.92 7.2 Favored Pre-proline 0 C--N 1.321 -0.633 0 C-N-CA 122.138 0.175 . . . . 0.0 110.695 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 23.4 Cg_exo -65.3 -42.35 13.57 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.614 2.209 . . . . 0.0 112.48 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -67.46 -44.28 78.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -72.34 -36.94 68.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -64.26 -36.45 84.14 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.453 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.19 92.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.032 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -71.58 -41.81 68.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.595 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.576 HD22 ' HB1' ' A' ' 11' ' ' ALA . 89.1 mt -68.45 -34.31 75.73 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.743 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -67.81 -34.81 77.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.849 0.357 . . . . 0.0 110.643 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.6 m -66.51 -35.61 80.68 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.89 -41.51 95.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.978 176.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.14 80.09 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.231 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 7.0 tp10 -71.64 -40.91 69.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.146 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.4 ttmt -66.06 -35.85 81.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.09 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.567 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.02 -36.86 82.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.721 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.445 ' HA ' ' NH2' ' A' ' 5' ' ' ARG . 25.0 t70 -65.8 -41.21 92.21 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.538 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 36.3 mt-10 -69.03 -25.73 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.302 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 85.0 mt -81.88 -15.36 54.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.811 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.399 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.401 -179.016 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 33.2 Cg_exo -61.06 -44.42 24.47 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.957 2.438 . . . . 0.0 112.883 -177.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -66.43 -44.57 82.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.86 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.24 -33.85 67.84 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.743 0.306 . . . . 0.0 110.562 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -62.36 -46.1 90.19 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.831 178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.85 -42.96 99.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.429 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.47 -44.14 79.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.608 HD22 ' HB1' ' A' ' 30' ' ' ALA . 50.1 mt -70.52 -36.58 73.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.567 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 tp -67.01 -43.71 82.18 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.703 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.7 p -67.95 -32.16 72.41 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.956 0.407 . . . . 0.0 110.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.49 85.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.013 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.41 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -61.71 -39.14 90.45 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.834 176.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 40.3 tt0 -70.01 -41.29 74.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.26 177.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -63.65 -43.45 96.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.942 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.427 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.7 -35.03 76.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.936 0.398 . . . . 0.0 110.248 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.28 -41.74 80.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.656 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 29.6 mm-40 -62.26 -33.31 74.38 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.964 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -87.76 -0.46 56.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.412 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.12 36.99 94.2 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.529 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.1 m -105.02 95.07 8.57 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.51 -42.32 21.9 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.818 2.345 . . . . 0.0 113.767 -177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -66.66 -44.56 81.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.053 0.454 . . . . 0.0 110.642 -178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -72.03 -35.82 69.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -62.06 -44.18 97.23 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.647 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.41 -43.7 96.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.119 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -42.52 84.38 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.144 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.484 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.2 mt -69.58 -37.92 77.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.534 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.41 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 25.7 mt -64.37 -36.64 84.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 0.0 110.277 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.455 HG22 ' HE3' ' A' ' 33' ' ' LYS . 50.4 m -70.74 -37.79 73.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.6 177.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.608 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.91 -35.96 81.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.61 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.54 94.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.145 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 47.9 mt-10 -72.24 -39.66 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.873 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HE3' HG22 ' A' ' 29' ' ' THR . 96.8 mttt -63.32 -40.36 97.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.456 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -67.37 -35.01 78.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.368 0.604 . . . . 0.0 109.816 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.66 -39.94 95.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.64 178.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 46.2 mt-10 -62.98 -33.98 76.55 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.241 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.97 -13.84 59.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.003 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.536 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.798 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.074 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 13.0 p . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.496 0.188 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 35.9 Cg_endo -64.57 -44.7 10.48 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.897 2.398 . . . . 0.0 113.422 -177.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.73 -41.3 75.49 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 120.804 0.335 . . . . 0.0 111.109 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -65.39 -40.9 94.02 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -62.98 -40.75 98.69 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.328 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.57 96.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -69.64 -44.7 70.07 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.066 0.46 . . . . 0.0 111.051 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.632 HD22 ' HB1' ' A' ' 30' ' ' ALA . 75.8 mt -71.05 -37.78 72.52 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.05 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 11.6 tp -67.43 -44.26 79.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.034 -178.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -64.02 -37.41 87.31 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.333 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.47 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.92 -38.75 92.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.132 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.27 96.9 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.966 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 9' ' ' LEU . 46.9 mm-40 -64.62 -40.82 96.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.453 178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.642 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -66.45 -45.66 79.03 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.872 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.79 78.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.238 0.542 . . . . 0.0 110.129 178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.79 -38.12 88.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.945 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -71.7 -29.2 64.3 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.64 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 72.5 mt -81.33 -16.28 52.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.639 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.51 26.37 61.32 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.546 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.6 t -103.28 104.42 40.84 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.43 -41.86 30.76 Favored 'Trans proline' 0 C--O 1.236 0.378 0 C-N-CA 122.888 2.392 . . . . 0.0 113.445 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.27 -44.83 95.64 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.881 0.372 . . . . 0.0 111.478 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -74.79 -38.98 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.581 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.404 ' HG2' HD12 ' A' ' 28' ' ' LEU . 69.0 ttt-85 -60.13 -44.74 94.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.269 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.12 82.77 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.965 0.412 . . . . 0.0 111.186 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -65.85 -41.74 91.31 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.76 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.47 HD22 ' CB ' ' A' ' 11' ' ' ALA . 56.7 mt -74.17 -37.4 63.99 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.257 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.404 HD12 ' HG2' ' A' ' 24' ' ' ARG . 19.7 mt -64.5 -40.64 96.02 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.827 0.346 . . . . 0.0 111.403 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.9 p -69.43 -32.58 71.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.01 0.433 . . . . 0.0 110.322 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.632 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -67.18 -40.88 86.65 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.083 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB1' HD12 ' A' ' 9' ' ' LEU . . . -59.91 -42.97 95.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.232 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -71.7 -33.6 68.93 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.432 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 40.7 ttmt -64.05 -49.81 70.88 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.639 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.64 -34.75 76.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.145 0.498 . . . . 0.0 110.339 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.05 -41.17 99.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.081 177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -66.02 -31.78 72.88 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.44 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.1 mt -75.94 -13.55 60.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.376 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.059 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.883 -179.297 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.668 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 26.0 Cg_exo -63.91 -44.36 13.3 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.019 2.479 . . . . 0.0 112.98 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.36 -43.69 92.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.866 0.365 . . . . 0.0 111.219 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.25 -39.35 65.5 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.372 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -61.77 -43.53 98.68 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.9 -42.95 99.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.232 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -70.97 -44.61 65.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.882 0.372 . . . . 0.0 111.38 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.604 HD22 ' HB1' ' A' ' 30' ' ' ALA . 67.4 mt -70.12 -39.05 75.67 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.157 -178.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.87 -40.58 79.19 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.236 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.402 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 13.8 p -67.32 -34.11 76.68 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.362 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.478 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.66 -39.75 94.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.903 177.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.97 94.25 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.963 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 34.0 tt0 -70.56 -41.36 72.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.172 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 10' ' ' THR . 2.3 mptm? -63.92 -44.17 93.71 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.565 0.221 . . . . 0.0 111.068 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.8 78.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.969 0.414 . . . . 0.0 109.961 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.35 -45.6 79.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.231 177.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 50.3 mt-10 -62.08 -34.73 76.84 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.627 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -82.29 -7.82 59.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.958 0.408 . . . . 0.0 111.483 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.568 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 76.15 32.43 52.46 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.105 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -101.36 95.64 5.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.568 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 21.9 Cg_exo -65.23 -42.6 13.08 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.87 2.38 . . . . 0.0 113.282 -176.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -69.58 -44.16 71.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.772 0.32 . . . . 0.0 110.868 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.3 -38.95 88.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.223 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -60.57 -45.17 94.93 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.14 94.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.788 0.328 . . . . 0.0 111.267 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -67.79 -40.84 83.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.478 HD22 ' CB ' ' A' ' 11' ' ' ALA . 65.4 mt -70.02 -35.57 74.45 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.145 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.5 mt -66.53 -32.01 73.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.329 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -62.79 -40.89 98.74 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.604 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -70.78 -38.66 73.41 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.228 179.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.12 94.13 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.689 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -72.83 -37.45 67.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.734 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -68.7 -48.6 63.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.748 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.19 -34.6 72.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.559 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.83 -42.4 98.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.336 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -63.78 -35.75 81.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.582 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.46 -14.66 59.64 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 120.992 0.425 . . . . 0.0 110.867 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.668 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.433 -1.541 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.652 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 120.441 0.162 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.541 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.6 Cg_exo -63.86 -44.08 14.28 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.024 2.483 . . . . 0.0 113.488 -177.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.45 -44.5 90.92 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.867 0.365 . . . . 0.0 110.611 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -66.14 -35.67 81.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.037 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.9 -43.86 97.64 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.445 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.05 -42.65 98.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.947 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -69.78 -44.01 70.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 111.441 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 30' ' ' ALA . 86.6 mt -70.44 -39.14 74.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.1 tp -69.1 -41.11 77.9 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.741 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.5 p -64.46 -32.82 74.61 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.596 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.477 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.51 -38.05 89.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.175 176.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -44.3 96.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.828 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -66.63 -39.68 88.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.286 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -68.07 -33.65 74.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.284 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -63.99 -34.88 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.938 0.399 . . . . 0.0 110.362 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.16 -41.91 85.21 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.6 -34.72 76.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.509 178.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.63 -17.48 41.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.931 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.89 33.38 65.95 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.072 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HA ' ' HD2' ' A' ' 21' ' ' PRO . 4.5 p -105.87 101.25 32.24 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.958 0.379 . . . . 0.0 110.699 179.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 20' ' ' CYS . 30.7 Cg_endo -62.19 -39.99 44.6 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.069 2.513 . . . . 0.0 114.346 -175.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.37 -43.25 86.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.125 0.488 . . . . 0.0 110.624 -177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.52 -38.75 62.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.324 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -59.62 -44.66 93.36 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.02 -178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.65 93.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.008 -179.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -68.82 -42.26 77.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.976 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.477 HD22 ' CB ' ' A' ' 11' ' ' ALA . 66.6 mt -67.1 -34.42 77.59 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.541 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 19.9 mt -67.01 -39.41 87.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.334 176.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.2 m -65.52 -35.17 80.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.069 0.461 . . . . 0.0 109.836 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.16 -39.07 93.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.196 176.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.92 97.94 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.212 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 37.4 mt-10 -71.95 -39.81 69.14 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.035 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 88.6 tttt -65.12 -40.54 94.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.13 -35.18 74.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.568 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.13 -44.51 91.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.168 176.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.64 -29.49 69.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.148 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 68.1 mt -78.92 -14.57 59.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.681 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.541 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.446 -0.664 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.294 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.554 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 16.6 m . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.18 -44.22 12.83 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.918 2.412 . . . . 0.0 113.679 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 37.7 tt0 -65.88 -43.79 87.3 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.947 -0.301 . . . . 0.0 110.892 -177.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.554 ' OE1' ' HB3' ' A' ' 1' ' ' SER . 20.0 mp0 -65.19 -39.5 92.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 58.0 ttp180 -62.03 -45.2 94.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.82 99.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.665 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 71.1 mm-40 -63.81 -43.15 97.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.059 0.456 . . . . 0.0 110.74 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.599 HD22 ' HB1' ' A' ' 30' ' ' ALA . 45.7 mt -70.5 -40.38 73.59 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.372 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -68.7 -40.08 80.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.472 -178.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.549 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 6.2 p -64.41 -37.35 87.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.861 0.362 . . . . 0.0 110.114 177.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.504 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.83 -36.97 84.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.425 177.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.32 -40.75 91.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.567 177.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -68.79 -41.26 78.97 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.394 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.606 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 29.2 mtpp -64.22 -44.69 91.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.323 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.9 -37.12 86.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.993 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.57 -44.2 78.76 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.959 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.15 -31.78 72.3 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.522 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 54.3 mt -82.76 -9.34 59.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.22 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.71 39.69 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.755 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 m -114.48 92.04 26.82 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.784 0.326 . . . . 0.0 110.743 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.84 -42.19 15.77 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.118 2.545 . . . . 0.0 113.118 -177.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 11.3 mp0 -62.43 -43.79 97.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.728 0.299 . . . . 0.0 110.678 -178.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.89 -39.54 79.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.042 0.449 . . . . 0.0 110.138 178.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -60.07 -43.6 95.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.665 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.41 -41.12 88.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.408 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 58.6 mm-40 -72.12 -37.09 69.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.09 0.472 . . . . 0.0 110.899 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.504 HD22 ' CB ' ' A' ' 11' ' ' ALA . 43.8 mt -73.27 -36.21 66.31 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.072 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 32.3 mt -67.21 -39.5 86.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.206 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.2 p -70.98 -32.82 69.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.153 0.502 . . . . 0.0 110.388 178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.599 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.19 -40.43 97.48 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.287 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.74 -40.57 88.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.409 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.65 -39.79 80.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.244 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -68.43 -40.88 81.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.655 -178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.84 -35.26 79.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.476 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -66.44 -36.97 84.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.312 178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.53 -33.05 74.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.158 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.9 -14.29 59.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.818 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.022 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.617 -178.232 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 CA--C 1.54 0.573 0 CA-C-O 120.591 0.234 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.3 Cg_exo -63.82 -45.33 11.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.148 2.565 . . . . 0.0 113.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.27 -44.22 88.76 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.037 0.446 . . . . 0.0 110.467 -178.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -66.29 -39.71 89.55 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.962 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -64.33 -39.51 94.05 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.146 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.71 -42.59 93.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.827 0.346 . . . . 0.0 111.322 -177.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -69.57 -44.13 71.47 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.694 HD22 ' HB1' ' A' ' 30' ' ' ALA . 88.8 mt -70.4 -37.7 74.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.281 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.3 tp -68.9 -39.71 79.55 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -67.48 -32.49 73.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.919 0.39 . . . . 0.0 110.303 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.557 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.81 -40.42 97.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.87 175.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.857 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -64.72 -41.21 96.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.161 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.401 ' O ' HD23 ' A' ' 18' ' ' LEU . 84.5 tttt -64.51 -45.82 85.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.994 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -65.99 -34.96 79.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -68.39 -38.95 81.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.01 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -66.95 -35.26 79.57 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.83 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.401 HD23 ' O ' ' A' ' 14' ' ' LYS . 4.1 mm? -81.03 -11.76 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.3 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.74 24.84 73.49 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.919 178.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.6 t -95.27 101.98 8.66 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -65.14 -43.0 12.23 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.806 2.337 . . . . 0.0 114.532 -173.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -71.36 -43.3 67.19 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.442 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.74 -35.06 78.06 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.277 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HG2' HD12 ' A' ' 28' ' ' LEU . 57.5 ttp180 -61.54 -43.97 97.9 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.122 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -43.62 98.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.776 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -65.92 -43.02 89.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.775 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD22 ' HB1' ' A' ' 11' ' ' ALA . 83.5 mt -73.28 -35.85 66.22 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.844 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD12 ' HG2' ' A' ' 24' ' ' ARG . 15.5 mt -67.58 -33.61 75.37 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.755 0.312 . . . . 0.0 110.511 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.9 m -63.82 -40.83 97.55 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.694 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -66.67 -39.84 88.35 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.628 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -43.82 95.35 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.246 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 64.5 mm-40 -73.09 -39.68 65.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.156 177.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.627 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.7 tptt -54.54 -55.69 26.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.953 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.87 -34.55 74.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.099 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.02 -42.33 97.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.113 177.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 57.5 mm-40 -65.67 -34.17 77.59 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.319 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 73.3 mt -76.67 -14.8 59.94 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.583 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.489 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.445 -0.728 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.59 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.739 0.304 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -63.94 -34.84 58.22 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.057 2.505 . . . . 0.0 112.09 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.08 -44.38 89.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.182 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -70.53 -33.9 71.68 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.66 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -62.37 -42.06 99.1 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.706 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.44 -42.92 99.5 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.923 0.392 . . . . 0.0 110.867 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.75 -40.6 88.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.211 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.546 HD22 ' HB1' ' A' ' 30' ' ' ALA . 53.1 mt -69.83 -37.94 76.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.445 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -65.39 -41.22 93.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.243 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.4 p -72.0 -32.18 66.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.939 0.4 . . . . 0.0 110.229 177.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.496 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.38 -37.76 86.98 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.436 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -60.76 -43.82 97.53 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.726 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.91 -33.88 72.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.339 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -65.13 -46.11 82.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.869 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.79 -36.32 83.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.957 0.408 . . . . 0.0 110.799 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.14 -41.24 94.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.863 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.09 -34.49 78.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.866 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.09 -11.84 58.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.03 34.79 29.24 Favored Glycine 0 N--CA 1.439 -1.134 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.046 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.1 m -111.19 90.82 12.2 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.04 -42.04 15.25 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.788 2.325 . . . . 0.0 113.353 -176.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.7 -43.14 80.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.607 0.241 . . . . 0.0 110.795 -177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.72 -38.62 87.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.51 -44.88 95.56 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.673 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.47 -41.87 90.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.268 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -69.28 -40.94 77.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.496 HD22 ' HB1' ' A' ' 11' ' ' ALA . 61.8 mt -68.58 -33.52 74.2 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.155 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' CD2' ' HB1' ' A' ' 12' ' ' ALA . 44.5 mt -66.32 -42.98 87.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.22 177.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.3 p -65.69 -31.78 72.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.86 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.9 -34.38 77.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.9 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.67 92.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.857 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.6 -40.29 66.64 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.972 0.415 . . . . 0.0 111.019 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.604 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 61.3 mmtt -65.12 -35.04 79.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.919 -178.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -62.24 -35.57 79.34 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.686 0.279 . . . . 0.0 110.901 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -67.65 -42.49 82.15 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.02 -33.36 75.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.678 177.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 86.6 mt -76.92 -14.46 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.87 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.47 -179.728 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.542 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 25.7 Cg_exo -63.09 -41.96 25.7 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.081 2.52 . . . . 0.0 113.556 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.72 -46.15 69.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.767 0.318 . . . . 0.0 111.15 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.8 -34.0 73.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.542 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.55 ' HG2' HD12 ' A' ' 9' ' ' LEU . 43.7 ttt180 -62.72 -45.33 93.23 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.739 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.68 -42.21 98.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.798 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -63.38 -44.48 94.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.852 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.547 HD22 ' HB1' ' A' ' 30' ' ' ALA . 55.8 mt -70.03 -40.6 75.07 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.614 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.55 HD12 ' HG2' ' A' ' 5' ' ' ARG . 13.6 mt -67.08 -36.08 81.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.984 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 14.2 p -71.99 -36.77 69.85 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.94 177.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.487 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.54 -37.35 85.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.164 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -60.71 -42.32 97.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.724 176.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -69.75 -41.07 75.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.286 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 32.4 mmtp -66.24 -40.55 90.31 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.597 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.07 -35.09 79.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.409 . . . . 0.0 110.384 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.85 -40.77 88.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.888 177.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -65.12 -28.39 69.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.325 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 85.0 mt -82.24 -11.18 58.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.718 178.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.76 50.08 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.724 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -114.54 91.84 26.34 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.33 -39.82 27.91 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.843 2.362 . . . . 0.0 112.802 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 33.0 tt0 -67.12 -43.17 83.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.723 0.297 . . . . 0.0 110.505 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -64.49 -42.2 96.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 56.3 ttt180 -60.73 -43.03 98.41 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.461 178.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.95 97.59 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.063 0.459 . . . . 0.0 111.155 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 90.6 mt-30 -65.73 -41.14 92.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD22 ' CB ' ' A' ' 11' ' ' ALA . 37.6 mt -73.54 -36.18 65.64 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.739 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.3 mt -66.73 -37.48 84.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.416 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -70.94 -31.85 68.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.158 0.504 . . . . 0.0 110.082 177.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.547 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.61 -35.2 80.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.21 82.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.72 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -69.49 -40.38 77.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.892 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -61.69 -49.23 77.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.837 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.455 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.12 -35.27 80.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.407 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -62.17 -46.67 87.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.514 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -66.91 -27.13 67.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.14 0.495 . . . . 0.0 110.321 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -76.77 -14.65 59.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.896 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.542 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.447 -0.617 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.909 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.77 -42.34 20.52 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.888 2.392 . . . . 0.0 113.892 -175.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -67.66 -46.11 73.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.021 0.439 . . . . 0.0 111.264 -177.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.13 -32.83 71.01 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.819 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.48 ' HG2' HD12 ' A' ' 9' ' ' LEU . 63.9 ttt-85 -61.5 -46.2 91.01 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.955 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.6 -43.24 94.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.59 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -66.35 -42.83 87.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.687 0.28 . . . . 0.0 111.682 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.523 HD22 ' HB1' ' A' ' 30' ' ' ALA . 68.5 mt -69.63 -38.31 77.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.727 0.298 . . . . 0.0 111.514 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.544 ' HG ' ' HB1' ' A' ' 31' ' ' ALA . 11.6 mt -67.45 -38.85 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.867 178.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -72.0 -32.81 67.55 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.577 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.485 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.39 -37.33 85.31 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.827 176.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.496 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.86 -44.55 96.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.285 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.12 -40.61 71.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.109 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.34 -37.2 86.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.537 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -37.98 88.63 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.479 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.61 -41.6 96.11 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.78 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.22 -34.79 75.69 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.612 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.3 tp -90.06 0.14 57.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.284 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.64 -92.99 1.51 Allowed Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -177.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' GLU . 36.1 m 25.32 70.18 0.39 Allowed Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.116 1.366 . . . . 0.0 113.769 175.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.3 -41.86 46.82 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.407 2.071 . . . . 0.0 112.78 -177.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.24 -44.23 63.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.917 0.389 . . . . 0.0 111.283 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 20' ' ' CYS . 31.5 mt-10 -66.08 -34.86 79.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.152 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 67.3 ttt180 -61.03 -43.47 98.84 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.184 178.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.25 95.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.566 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.29 -41.9 99.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.658 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.485 HD22 ' CB ' ' A' ' 11' ' ' ALA . 48.2 mt -68.92 -38.35 79.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.055 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.496 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 37.1 mt -65.69 -32.51 74.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 176.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.0 m -68.04 -40.28 82.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.731 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.523 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.18 -35.76 81.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.685 177.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HG ' ' A' ' 9' ' ' LEU . . . -59.27 -43.27 92.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.861 179.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -72.69 -39.45 67.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 39.5 ttmt -63.12 -45.64 91.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.897 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -65.04 -34.94 79.62 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.049 0.452 . . . . 0.0 110.225 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.28 -43.72 97.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.409 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.99 -30.53 71.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.971 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.3 mt -76.91 -13.41 59.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.991 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.007 0 C-N-CA 120.688 -0.767 . . . . 0.0 111.823 -178.561 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -58.84 -44.31 36.85 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.133 2.555 . . . . 0.0 113.638 -177.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -64.59 -42.93 95.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.842 0.354 . . . . 0.0 111.41 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -73.38 -34.3 65.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.274 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -62.34 -45.1 94.73 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.992 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.77 99.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.274 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -68.66 -44.88 73.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.923 -179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.645 HD22 ' HB1' ' A' ' 30' ' ' ALA . 81.7 mt -70.52 -36.42 73.73 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.916 -179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.1 tp -68.85 -40.79 79.15 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.944 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.5 p -68.19 -32.8 73.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.122 0.487 . . . . 0.0 110.043 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.525 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.63 -37.23 85.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.86 175.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.91 94.09 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.545 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 31.2 mt-10 -70.25 -34.45 72.85 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.079 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.476 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 55.2 mttp -63.5 -44.8 93.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.593 0.235 . . . . 0.0 110.915 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.55 78.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.123 0.487 . . . . 0.0 109.798 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -64.03 -42.65 97.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.574 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 24.2 mm-40 -62.01 -34.32 75.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.836 177.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 67.3 mt -81.55 -15.97 53.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.798 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.37 33.31 48.95 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.793 179.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.5 p -113.82 97.79 45.57 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.046 0.451 . . . . 0.0 110.944 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.14 -37.04 86.49 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 123.123 2.549 . . . . 0.0 113.341 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.54 -46.0 90.38 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.779 0.323 . . . . 0.0 111.204 -176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -76.43 -35.3 58.6 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.862 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -60.75 -43.25 98.21 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.322 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.2 -42.71 95.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.651 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -65.37 -42.89 92.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.525 HD22 ' HB1' ' A' ' 11' ' ' ALA . 60.2 mt -71.38 -35.78 71.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.654 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 29.1 mt -66.16 -34.4 77.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.922 0.391 . . . . 0.0 110.414 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.5 m -64.78 -36.84 85.61 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.419 0.628 . . . . 0.0 109.361 176.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.645 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -69.45 -38.68 77.91 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.641 178.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.49 93.75 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.903 177.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -70.75 -40.48 72.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.625 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -64.72 -43.19 94.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.015 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.62 -35.14 79.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.457 . . . . 0.0 110.434 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.06 -42.87 84.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.258 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -63.47 -35.4 80.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.036 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 37' ' ' LEU . 1.9 tm? -77.1 -14.89 59.74 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.221 0.534 . . . . 0.0 110.13 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.824 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.92 -179.474 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 110.555 -0.165 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 38' ' ' GLY . 24.1 Cg_exo -64.14 -45.07 10.74 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.797 2.332 . . . . 0.0 113.019 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 59.2 mm-40 -68.22 -42.94 79.04 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.709 0.29 . . . . 0.0 111.145 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -66.01 -39.68 90.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.426 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -62.24 -43.49 98.71 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.323 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.87 -42.91 98.83 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.121 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.8 mm100 -70.01 -44.39 69.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.939 0.399 . . . . 0.0 111.379 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.62 HD22 ' HB1' ' A' ' 30' ' ' ALA . 79.2 mt -71.09 -38.31 72.41 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.34 -178.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.38 -44.01 79.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 120.644 0.259 . . . . 0.0 111.066 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.8 p -67.15 -32.66 73.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.5 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.41 -37.41 85.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.248 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.466 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -60.56 -39.22 87.18 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.791 178.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.54 -39.68 73.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.269 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 67.9 mttm -64.61 -45.14 88.17 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.912 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -61.78 -36.32 80.74 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.924 0.393 . . . . 0.0 110.814 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.81 -44.76 84.71 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.192 0.52 . . . . 0.0 109.615 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.22 -31.68 72.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.056 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 95.3 mt -82.46 -16.01 50.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.518 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.98 29.86 27.48 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.227 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.5 m -102.72 97.84 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.77 -43.86 9.03 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.36 2.04 . . . . 0.0 113.435 -176.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.52 -42.92 64.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.029 0.442 . . . . 0.0 110.594 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.78 -34.26 77.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.017 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -59.91 -44.73 94.12 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -39.26 77.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.941 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -63.26 -42.49 99.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.095 0.474 . . . . 0.0 110.556 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.515 HD12 ' HB2' ' A' ' 15' ' ' ALA . 57.6 mt -75.3 -35.84 61.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.922 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HG ' ' HB1' ' A' ' 12' ' ' ALA . 18.5 mt -64.18 -39.35 93.8 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 p -70.96 -34.63 71.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.944 0.402 . . . . 0.0 110.075 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.62 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -63.76 -35.82 81.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.447 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.95 90.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.76 177.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -71.66 -40.12 69.86 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.905 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 65.2 mttm -57.19 -54.8 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.426 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -61.83 -35.89 79.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.89 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.05 -42.36 89.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.405 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.94 -33.59 76.41 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.169 178.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 90.8 mt -79.41 -14.45 58.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.386 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.571 ' O ' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.444 -0.781 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.207 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 68.6 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 30.7 Cg_endo -63.36 -38.38 43.75 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.97 2.447 . . . . 0.0 112.787 -177.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -69.45 -44.04 72.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 0.0 110.282 -178.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -66.63 -36.68 83.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.805 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.494 ' HD3' ' OD1' ' A' ' 35' ' ' ASP . 8.8 ttm180 -61.68 -46.44 89.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.642 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.92 -39.91 91.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.19 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -64.86 -45.75 84.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.723 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.734 HD23 ' HB2' ' A' ' 34' ' ' ALA . 0.5 OUTLIER -71.66 -43.77 65.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.472 HD13 ' HG2' ' A' ' 5' ' ' ARG . 10.5 mp -62.35 -37.85 87.27 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.412 -178.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 21.9 p -72.09 -32.45 67.03 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.274 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.63 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -62.36 -37.46 85.75 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.612 177.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.85 97.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.603 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.17 -37.2 78.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.395 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 68.5 mttm -64.75 -36.44 84.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.634 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -66.22 -35.38 80.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.984 177.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.29 -43.14 99.37 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.809 175.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -67.25 -34.76 78.14 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.756 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 76.8 mt -81.88 -17.59 46.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.096 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.403 ' O ' ' HD3' ' A' ' 21' ' ' PRO . . . 69.84 28.82 71.5 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 113.016 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 23' ' ' GLU . 4.0 p -105.14 102.17 34.77 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.906 0.384 . . . . 0.0 111.168 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 19' ' ' GLY . 43.0 Cg_exo -57.78 -41.71 67.03 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.264 2.643 . . . . 0.0 113.62 -177.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.86 -44.81 84.33 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.334 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 34.7 mt-10 -69.63 -36.13 75.85 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.975 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -60.97 -44.37 97.45 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.838 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.77 97.9 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.87 0.367 . . . . 0.0 111.181 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -70.85 -41.13 71.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.235 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.63 HD22 ' HB1' ' A' ' 11' ' ' ALA . 78.2 mt -67.39 -34.34 77.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.717 0.294 . . . . 0.0 111.091 178.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.2 mt -69.49 -32.49 71.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.545 175.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.8 m -67.75 -43.95 78.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.506 ' HB1' ' HG ' ' A' ' 8' ' ' LEU . . . -63.31 -39.27 94.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.351 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.593 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . . . -62.03 -44.53 96.5 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.158 0.504 . . . . 0.0 110.42 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 5.7 tp10 -67.29 -39.5 85.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.01 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -66.28 -41.02 90.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.216 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.734 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -62.25 -36.73 82.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.317 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' OD1' ' HD3' ' A' ' 5' ' ' ARG . 4.5 m-20 -60.87 -41.88 96.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.734 176.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 38.0 mt-10 -70.38 -33.48 71.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.375 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.85 -14.23 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.738 0.304 . . . . 0.0 111.255 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.436 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.385 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -61.48 -44.36 22.92 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.038 2.492 . . . . 0.0 114.227 -173.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.82 -45.11 75.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.025 0.441 . . . . 0.0 110.461 -177.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -68.78 -34.96 76.44 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.516 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.515 ' O ' HD23 ' A' ' 9' ' ' LEU . 35.6 ttp180 -62.53 -47.75 82.52 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.994 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.85 95.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.137 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -68.97 -45.28 71.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.563 -178.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 30' ' ' ALA . 58.9 mt -70.63 -41.67 71.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 5' ' ' ARG . 4.2 mm? -63.0 -42.55 99.88 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-O 120.769 0.319 . . . . 0.0 111.03 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.9 p -70.1 -35.17 73.96 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.189 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.466 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -62.45 -38.94 91.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.246 177.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -43.85 98.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.281 0.562 . . . . 0.0 109.502 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 13.9 mm-40 -68.02 -40.8 82.85 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.372 179.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 96.5 mttt -67.81 -37.63 82.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.412 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.1 -35.15 79.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.138 0.495 . . . . 0.0 109.945 176.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.42 ' HB3' ' O ' ' A' ' 13' ' ' GLU . 16.3 t70 -63.76 -44.65 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.374 175.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 96.3 mt-10 -65.75 -28.77 69.28 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.333 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 14' ' ' LYS . 47.7 mt -82.84 -11.78 57.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.855 0.36 . . . . 0.0 111.086 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.36 50.38 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.363 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.5 m -116.28 89.07 25.03 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.59 -37.13 38.93 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.703 2.269 . . . . 0.0 112.73 -177.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -64.57 -43.88 92.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.568 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -73.59 -34.64 65.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.311 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -60.02 -43.91 94.96 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.423 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.887 0.375 . . . . 0.0 110.836 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.83 -40.13 94.69 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.338 0.589 . . . . 0.0 110.308 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.466 HD22 ' CB ' ' A' ' 11' ' ' ALA . 45.0 mt -74.7 -34.64 62.67 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.198 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.3 mt -65.27 -42.4 93.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.301 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 p -64.22 -36.1 82.98 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.25 0.548 . . . . 0.0 109.941 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.489 ' CB ' HD22 ' A' ' 8' ' ' LEU . . . -69.3 -40.41 77.71 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.315 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 9' ' ' LEU . . . -60.59 -43.73 97.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.727 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -66.34 -40.03 89.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.892 -178.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -73.11 -35.11 66.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.483 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -64.42 -38.06 89.69 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.834 0.35 . . . . 0.0 110.971 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -63.21 -47.51 82.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.801 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.0 -21.18 61.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.949 0.404 . . . . 0.0 111.112 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.26 -15.69 59.96 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.279 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.578 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.721 179.277 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 120.948 0.404 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -57.39 -34.62 98.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.945 2.43 . . . . 0.0 112.83 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.15 -44.01 93.45 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.862 0.363 . . . . 0.0 110.853 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -72.27 -35.68 68.81 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.439 ' HA ' ' CB ' ' A' ' 34' ' ' ALA . 56.3 ttp180 -62.38 -46.18 89.8 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.897 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.01 97.85 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.91 0.386 . . . . 0.0 110.892 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -67.59 -46.08 73.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.282 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.666 HD12 ' HB2' ' A' ' 34' ' ' ALA . 65.8 mt -72.26 -40.41 67.68 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.53 -41.92 88.01 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 15.6 p -64.11 -38.12 89.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.371 . . . . 0.0 110.297 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.439 ' CB ' HD22 ' A' ' 27' ' ' LEU . . . -64.23 -38.67 91.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.168 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.475 ' HB1' HD23 ' A' ' 28' ' ' LEU . . . -62.13 -42.67 99.47 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.935 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.82 -41.35 91.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.569 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 10' ' ' THR . 97.5 mttt -63.85 -44.43 93.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.68 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.36 -43.52 85.79 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.948 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' HD2' ' A' ' 24' ' ' ARG . 17.9 t70 -59.17 -42.99 92.09 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.019 0.438 . . . . 0.0 110.963 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.97 -35.07 77.4 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.523 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.2 tp -93.31 -17.0 24.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.95 0.405 . . . . 0.0 111.551 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.19 -99.91 1.57 Allowed Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -178.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.0 m 42.21 79.68 0.32 Allowed Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 123.543 0.737 . . . . 0.0 111.801 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.56 -43.87 53.94 Favored 'Trans proline' 0 CA--C 1.531 0.336 0 C-N-CA 122.736 2.291 . . . . 0.0 113.896 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -74.11 -43.45 57.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.88 0.372 . . . . 0.0 111.633 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.24 -43.24 74.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.502 -177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.417 ' HD2' ' OD1' ' A' ' 16' ' ' ASP . 9.5 ttp180 -62.18 -44.37 96.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.635 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.91 96.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.574 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -73.18 -38.89 65.99 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.941 -178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.439 HD22 ' CB ' ' A' ' 11' ' ' ALA . 70.7 mt -70.73 -38.32 73.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.702 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.475 HD23 ' HB1' ' A' ' 12' ' ' ALA . 29.0 mt -67.08 -39.63 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.664 0.269 . . . . 0.0 111.36 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -71.0 -33.22 70.19 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.865 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -64.19 -36.04 82.78 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.372 176.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.22 96.02 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.847 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -71.97 -40.33 68.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.899 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 69.1 mmtt -66.91 -36.45 82.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.545 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -63.21 -41.6 99.17 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.155 0.502 . . . . 0.0 110.387 178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.56 -38.12 83.67 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.553 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.44 -33.62 74.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.491 177.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 95.6 mt -76.68 -15.48 59.78 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.126 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.004 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.787 -179.804 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.445 -0.713 0 CA-C-O 120.68 0.276 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.18 -40.67 31.7 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.968 2.445 . . . . 0.0 113.493 -177.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 7' ' ' GLN . 13.8 tp10 -64.3 -44.89 90.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.14 0.495 . . . . 0.0 109.888 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -65.96 -41.78 90.79 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.25 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.9 ttm105 -61.87 -46.86 87.6 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.409 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.62 93.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.854 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 79.4 mm-40 -70.04 -44.8 68.47 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.732 HD12 ' HB2' ' A' ' 34' ' ' ALA . 75.5 mt -71.21 -37.12 72.1 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.5 tp -69.28 -42.93 74.84 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 120.587 0.232 . . . . 0.0 111.387 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -64.98 -32.83 74.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.705 0.288 . . . . 0.0 110.89 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -63.92 -42.62 97.33 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.164 0.506 . . . . 0.0 109.642 176.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB1' ' HG ' ' A' ' 28' ' ' LEU . . . -62.13 -44.21 97.13 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.385 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -66.4 -41.09 89.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -65.37 -44.34 87.9 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.08 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.02 85.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -59.57 -37.54 78.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.116 0.484 . . . . 0.0 111.075 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -61.35 -34.71 75.74 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.856 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.5 tp -93.33 -0.53 56.62 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.707 0.765 . . . . 0.0 110.163 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.84 -101.19 2.68 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.7 m 38.47 70.75 1.22 Allowed Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 123.594 0.758 . . . . 0.0 111.615 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HG2' ' A' ' 24' ' ' ARG . 44.8 Cg_exo -55.66 -42.92 62.7 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.578 2.185 . . . . 0.0 113.579 -174.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -72.24 -38.2 68.98 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.457 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -72.39 -43.54 63.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.369 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.441 ' HG2' ' HA ' ' A' ' 21' ' ' PRO . 38.2 ptt180 -64.31 -36.59 84.61 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.117 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.71 -44.42 96.96 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 111.267 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.51 -39.35 74.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.662 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.453 HD22 ' HB1' ' A' ' 11' ' ' ALA . 64.8 mt -67.84 -39.54 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.063 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 26.5 mt -64.4 -36.99 85.94 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.834 177.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.636 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 87.6 m -63.57 -41.96 98.35 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 176.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.668 ' HB1' HD22 ' A' ' 8' ' ' LEU . . . -62.68 -36.07 81.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.384 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.95 95.88 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.9 176.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 36.8 mt-10 -70.55 -40.27 73.49 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.63 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 29' ' ' THR . 30.4 mmmt -64.11 -42.73 96.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.925 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.732 ' HB2' HD12 ' A' ' 8' ' ' LEU . . . -60.62 -35.88 77.24 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.817 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.42 -38.41 84.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.585 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -66.19 -26.6 67.48 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.19 0.519 . . . . 0.0 110.615 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 33' ' ' LYS . 70.8 mt -77.3 -14.54 59.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.34 177.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.631 -179.938 . . . . . . . . 0 0 . 1 stop_ save_