data_2jof_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 2jof _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 119.104 -0.474 . . . . 20.0 112.056 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.07 -38.48 91.35 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.0 0.818 . . . . 20.0 112.229 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.48 -48.63 74.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.213 0.605 . . . . 20.0 110.813 173.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -67.27 -42.65 83.51 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.253 0.621 . . . . 20.0 112.117 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -47.3 -50.31 21.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.155 1.382 . . . . 20.0 111.984 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.83 -46.23 85.99 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.301 -0.857 . . . . 20.0 112.521 173.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -54.25 -44.17 71.56 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.389 0.995 . . . . 20.0 113.107 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.2 -18.72 65.53 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.536 0.939 . . . . 20.0 113.536 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.52 9.16 10.47 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.869 1.223 . . . . 20.0 115.17 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.16 -112.44 1.3 Allowed Glycine 0 CA--C 1.535 1.315 0 C-N-CA 127.258 2.361 . . . . 20.0 113.695 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.18 -30.4 60.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.246 2.631 . . . . 20.0 113.88 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -60.26 -38.58 83.94 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.007 1.323 . . . . 20.0 111.847 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.42 -18.3 45.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 126.472 1.909 . . . . 20.0 113.229 -174.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.57 -13.64 1.58 Allowed Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.938 1.733 . . . . 20.0 116.368 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -54.66 126.52 57.3 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.077 1.438 . . . . 20.0 111.229 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -52.59 129.71 33.39 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.279 2.653 . . . . 20.0 112.809 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -64.84 140.09 65.37 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.289 1.993 . . . . 20.0 111.941 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.538 0.704 0 C-N-CA 123.244 2.629 . . . . 20.0 110.75 176.183 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 112.463 0.542 . . . . 20.0 112.463 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -63.7 -37.27 86.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.256 0.622 . . . . 20.0 112.158 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.89 79.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.718 0.807 . . . . 20.0 111.032 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -69.75 -38.69 76.89 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.348 0.499 . . . . 20.0 112.348 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 t90 -51.17 -52.59 42.73 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.213 1.005 . . . . 20.0 111.451 174.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.4 -44.42 96.48 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.693 0.627 . . . . 20.0 112.693 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.45 57.79 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.517 1.303 . . . . 20.0 114.517 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.66 15.81 19.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.154 0.982 . . . . 20.0 112.941 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.12 20.98 37.01 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.494 1.045 . . . . 20.0 112.96 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.15 -114.36 3.64 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.197 1.855 . . . . 20.0 111.495 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -52.65 -28.78 38.65 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.092 3.195 . . . . 20.0 114.205 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -54.43 -29.28 48.84 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.079 1.351 . . . . 20.0 112.47 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -20.62 62.95 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.938 1.695 . . . . 20.0 113.55 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.17 17.12 65.49 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 124.703 1.145 . . . . 20.0 115.734 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 139.02 21.22 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 125.36 1.464 . . . . 20.0 111.167 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -52.55 129.38 31.84 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 123.732 2.955 . . . . 20.0 113.124 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -67.23 133.82 31.81 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.721 2.281 . . . . 20.0 111.912 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo . . . . . 0 CA--C 1.54 0.792 0 C-N-CA 123.797 2.998 . . . . 20.0 111.348 -178.228 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 112.576 0.584 . . . . 20.0 112.576 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -64.97 -38.83 92.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.74 1.616 . . . . 20.0 112.503 -176.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.75 -48.16 72.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.763 0.825 . . . . 20.0 111.013 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.32 -43.09 87.17 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.181 0.592 . . . . 20.0 111.68 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 49.4 t90 -53.28 -47.55 69.07 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.045 0.938 . . . . 20.0 112.041 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.99 -46.66 89.85 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 119.111 -0.471 . . . . 20.0 111.746 171.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.814 1.246 . . . . 20.0 113.899 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -67.69 -17.92 64.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.883 1.273 . . . . 20.0 113.632 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 21.37 4.25 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.345 1.45 . . . . 20.0 114.818 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.99 -129.22 38.05 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.548 1.174 . . . . 20.0 111.151 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.42 -10.33 22.13 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 121.952 1.768 . . . . 20.0 113.07 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -59.68 -34.64 73.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.868 1.267 . . . . 20.0 112.994 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.87 -4.51 38.32 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.015 1.726 . . . . 20.0 113.531 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.95 9.89 86.61 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 124.085 0.85 . . . . 20.0 114.795 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -94.55 133.3 27.11 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 125.379 1.472 . . . . 20.0 110.581 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.92 144.71 65.54 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.041 1.828 . . . . 20.0 111.55 176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.59 136.81 40.54 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.884 2.389 . . . . 20.0 111.302 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo . . . . . 0 CA--C 1.537 0.626 0 C-N-CA 122.923 2.415 . . . . 20.0 110.647 175.427 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 113.299 0.852 . . . . 20.0 113.299 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.58 -33.63 70.18 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.848 0.859 . . . . 20.0 112.853 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.34 -48.56 74.01 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.285 1.034 . . . . 20.0 111.803 171.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -67.46 -43.43 81.06 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.836 0.455 . . . . 20.0 110.838 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -47.9 -50.55 26.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.231 1.012 . . . . 20.0 112.029 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.61 -40.54 92.75 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.192 0.812 . . . . 20.0 113.192 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -32.39 66.96 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.446 1.276 . . . . 20.0 114.446 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -77.78 -12.8 60.01 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.502 0.927 . . . . 20.0 113.502 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.24 7.7 34.7 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.348 1.451 . . . . 20.0 114.382 -175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.85 -113.71 5.31 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.143 -1.365 . . . . 20.0 112.528 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.51 -29.65 60.75 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.38 2.72 . . . . 20.0 114.817 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.9 p -56.39 -39.41 72.92 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.972 0.909 . . . . 20.0 112.887 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -82.8 -16.39 47.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.998 1.319 . . . . 20.0 113.052 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.01 -7.57 3.06 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.379 1.466 . . . . 20.0 116.238 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.48 125.08 51.25 Favored Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 119.195 1.497 . . . . 20.0 110.942 174.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.38 128.43 27.67 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.254 2.636 . . . . 20.0 112.961 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 136.01 42.69 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.383 2.056 . . . . 20.0 111.486 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 N--CA 1.457 -0.641 0 C-N-CA 122.789 2.326 . . . . 20.0 109.569 176.199 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.1 0 N-CA-C 117.379 2.363 . . . . 20.0 117.379 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.07 -38.12 75.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.277 1.431 . . . . 20.0 113.539 -175.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.96 81.64 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.544 -0.723 . . . . 20.0 111.479 174.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -65.8 -42.71 90.38 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.522 0.729 . . . . 20.0 111.241 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -49.67 -52.14 33.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.161 0.584 . . . . 20.0 111.381 174.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.98 -45.29 94.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.64 0.776 . . . . 20.0 112.796 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -52.56 -41.41 63.53 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.241 1.416 . . . . 20.0 113.184 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.78 8.31 3.82 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.734 1.614 . . . . 20.0 114.183 176.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.31 18.1 53.81 Favored Glycine 0 CA--C 1.532 1.129 0 O-C-N 120.631 -1.293 . . . . 20.0 113.532 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.95 -113.58 3.35 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.377 1.942 . . . . 20.0 112.472 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -53.32 -28.43 43.2 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.284 2.656 . . . . 20.0 113.61 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -55.33 -38.14 68.34 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.951 1.3 . . . . 20.0 112.152 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.7 p -72.44 -9.59 58.73 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 115.324 1.601 . . . . 20.0 115.324 174.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.59 17.43 62.34 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 119.997 1.272 . . . . 20.0 115.569 175.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -106.82 135.24 19.57 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 125.412 1.485 . . . . 20.0 111.316 -176.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.28 125.92 18.98 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.727 2.952 . . . . 20.0 113.281 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.14 135.21 39.49 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.492 2.128 . . . . 20.0 112.309 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 CA--C 1.537 0.625 0 C-N-CA 123.738 2.958 . . . . 20.0 111.254 -177.957 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 115.032 1.493 . . . . 20.0 115.032 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -60.38 -32.09 70.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.524 1.13 . . . . 20.0 113.266 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.5 98.76 Favored 'General case' 0 CA--C 1.537 0.442 0 O-C-N 121.891 -0.505 . . . . 20.0 110.683 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -41.9 75.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.248 1.019 . . . . 20.0 111.383 175.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.2 t90 -51.86 -51.14 58.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.633 0.773 . . . . 20.0 112.244 175.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.48 -36.48 82.63 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.943 0.72 . . . . 20.0 112.943 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -60.21 -33.32 72.09 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.683 1.193 . . . . 20.0 113.582 -177.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -83.24 3.68 30.15 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.983 1.313 . . . . 20.0 113.447 173.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.48 16.27 34.97 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 120.95 -1.094 . . . . 20.0 114.023 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.14 -107.02 0.84 Allowed Glycine 0 CA--C 1.533 1.194 0 C-N-CA 126.852 2.168 . . . . 20.0 113.277 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -55.66 -30.04 73.48 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.535 2.157 . . . . 20.0 113.508 172.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -57.35 -36.01 70.66 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.082 1.353 . . . . 20.0 112.473 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -15.85 61.78 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.931 1.692 . . . . 20.0 113.245 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.88 4.14 13.35 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.129 1.347 . . . . 20.0 115.744 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -79.88 136.03 55.0 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 125.672 1.589 . . . . 20.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_exo -44.71 121.21 3.22 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.193 3.262 . . . . 20.0 113.564 173.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.61 124.73 12.78 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.927 2.418 . . . . 20.0 110.589 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 CA--C 1.539 0.77 0 C-N-CA 121.887 1.725 . . . . 20.0 110.879 174.266 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.97 1.1 . . . . 20.0 113.97 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.29 -32.84 74.36 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.649 0.779 . . . . 20.0 112.623 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.2 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.676 0.791 . . . . 20.0 111.386 173.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -66.59 -45.57 78.81 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.562 -0.732 . . . . 20.0 110.946 175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -48.55 -49.29 36.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.531 0.732 . . . . 20.0 112.63 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.32 -46.54 85.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.006 0.522 . . . . 20.0 112.398 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -55.53 -32.21 62.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.627 1.171 . . . . 20.0 113.637 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -82.16 17.46 1.63 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.168 1.387 . . . . 20.0 114.252 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.61 27.9 37.37 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.331 1.443 . . . . 20.0 112.846 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -115.21 4.78 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.263 1.411 . . . . 20.0 111.697 -172.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.93 -8.61 17.9 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.239 1.959 . . . . 20.0 113.519 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.9 m -55.99 -36.45 67.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.899 1.279 . . . . 20.0 113.764 -171.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.07 -4.31 54.82 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.872 2.069 . . . . 20.0 113.514 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.97 -10.83 31.3 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.237 1.399 . . . . 20.0 115.421 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.79 117.65 22.64 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.196 1.799 . . . . 20.0 111.081 172.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.28 137.02 76.06 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 122.973 2.449 . . . . 20.0 112.969 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -66.36 134.31 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.861 2.374 . . . . 20.0 112.6 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 C--N 1.349 0.591 0 C-N-CA 123.325 2.683 . . . . 20.0 110.142 178.356 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 114.426 1.269 . . . . 20.0 114.426 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -63.93 -36.62 84.56 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.228 1.011 . . . . 20.0 112.273 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.62 82.46 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 122.969 0.508 . . . . 20.0 110.495 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -67.05 -38.82 86.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.452 0.538 . . . . 20.0 112.452 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -52.12 -51.55 57.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.886 0.875 . . . . 20.0 111.152 174.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.41 -45.32 94.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 119.094 -0.479 . . . . 20.0 112.159 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -55.39 -38.73 69.25 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.092 1.145 . . . . 20.0 114.092 -178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.0 5.7 4.03 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.356 1.243 . . . . 20.0 114.356 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.59 37.35 Favored Glycine 0 CA--C 1.531 1.084 0 O-C-N 120.616 -1.303 . . . . 20.0 112.913 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.99 -113.16 3.37 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.38 1.943 . . . . 20.0 112.523 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.78 -28.24 56.6 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.494 2.796 . . . . 20.0 114.131 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.5 m -52.47 -37.81 57.95 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 20.0 112.194 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -24.03 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.412 2.285 . . . . 20.0 114.578 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.61 1.66 Allowed Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.505 1.526 . . . . 20.0 116.884 -172.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.45 132.34 95.34 Favored Pre-proline 0 N--CA 1.476 0.838 0 CA-C-N 119.956 1.878 . . . . 20.0 111.281 174.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.5 126.81 18.8 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.503 2.802 . . . . 20.0 112.319 171.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -64.36 138.53 61.0 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.191 1.928 . . . . 20.0 111.501 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 N--CA 1.457 -0.634 0 C-N-CA 122.305 2.003 . . . . 20.0 110.764 175.775 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.58 0 N-CA-C 112.92 0.711 . . . . 20.0 112.92 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.34 -34.98 71.22 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.881 0.872 . . . . 20.0 112.821 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.73 -50.3 72.64 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 20.0 111.032 174.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -70.26 -33.84 72.08 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.545 0.738 . . . . 20.0 112.389 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -52.19 -55.19 22.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.767 0.827 . . . . 20.0 110.746 172.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.01 -47.15 87.78 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.829 -0.605 . . . . 20.0 112.331 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -39.53 70.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.549 0.74 . . . . 20.0 112.822 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -85.58 32.05 0.58 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.051 1.74 . . . . 20.0 112.379 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.73 27.29 54.4 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.396 0.998 . . . . 20.0 114.138 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.89 -116.92 8.92 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 118.087 0.943 . . . . 20.0 111.498 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.53 -14.95 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.062 1.842 . . . . 20.0 113.534 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -61.29 -23.64 65.84 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.284 1.216 . . . . 20.0 114.284 -174.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -3.23 33.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.733 1.213 . . . . 20.0 113.894 175.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.72 8.38 87.74 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.727 1.149 . . . . 20.0 114.87 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -97.65 127.35 37.89 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 125.664 1.586 . . . . 20.0 110.59 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -52.15 140.04 51.69 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.672 2.248 . . . . 20.0 112.377 172.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.52 130.4 28.12 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 122.634 2.223 . . . . 20.0 111.196 175.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo . . . . . 0 CA--C 1.539 0.728 0 C-N-CA 122.175 1.917 . . . . 20.0 110.799 174.575 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 113.134 0.791 . . . . 20.0 113.134 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.6 -34.91 73.35 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.91 0.884 . . . . 20.0 112.454 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.73 -31.31 72.21 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.8 0.84 . . . . 20.0 112.636 175.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -43.11 20.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.955 0.902 . . . . 20.0 110.571 171.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -48.0 -52.54 19.51 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.513 1.125 . . . . 20.0 112.316 176.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.4 mt -60.73 -39.05 87.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -59.17 -41.49 88.53 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.926 1.69 . . . . 20.0 111.954 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -76.01 28.66 0.11 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 126.683 1.993 . . . . 20.0 114.15 172.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.18 28.28 66.61 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 125.155 1.359 . . . . 20.0 113.698 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.76 -117.09 6.75 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.97 1.271 . . . . 20.0 111.56 -173.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -75.82 -10.81 20.01 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.04 1.827 . . . . 20.0 113.396 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -54.8 -39.58 68.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.308 1.043 . . . . 20.0 113.252 -173.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.7 m -75.81 -8.9 57.99 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.584 1.327 . . . . 20.0 114.584 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.01 -10.72 46.25 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 115.973 1.149 . . . . 20.0 115.973 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -58.7 122.84 64.31 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 118.93 1.365 . . . . 20.0 111.127 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -54.19 136.38 67.85 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.003 2.469 . . . . 20.0 112.931 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.64 130.26 24.45 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.783 2.322 . . . . 20.0 111.752 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 C-N-CA 122.727 2.284 . . . . 20.0 109.766 176.203 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.907 0 N-CA-C 114.194 1.183 . . . . 20.0 114.194 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.14 -37.63 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.5 1.12 . . . . 20.0 113.458 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.33 -45.44 91.34 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.635 -0.665 . . . . 20.0 111.372 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -66.92 -35.22 79.5 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.408 0.683 . . . . 20.0 111.836 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.7 t90 -58.26 -52.08 67.07 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.191 -0.943 . . . . 20.0 111.268 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -59.14 -44.62 92.06 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.371 0.668 . . . . 20.0 112.657 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -38.06 53.66 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.52 1.128 . . . . 20.0 113.596 176.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -83.63 26.49 0.68 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.956 1.702 . . . . 20.0 113.44 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.08 26.01 65.23 Favored Glycine 0 CA--C 1.531 1.066 0 O-C-N 121.09 -1.006 . . . . 20.0 112.986 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.14 -115.05 4.2 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.078 1.323 . . . . 20.0 111.65 -174.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -75.0 -9.72 20.9 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.209 1.939 . . . . 20.0 113.345 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 t -62.2 -34.01 75.65 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.711 1.004 . . . . 20.0 113.711 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.0 m -78.37 0.14 26.81 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.007 1.114 . . . . 20.0 114.007 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.25 14.23 82.53 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 119.432 1.015 . . . . 20.0 114.939 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -98.43 123.31 50.81 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 126.143 1.777 . . . . 20.0 110.239 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.74 138.63 59.51 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.917 2.411 . . . . 20.0 112.553 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.47 136.3 49.9 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.718 2.279 . . . . 20.0 111.928 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 CA--C 1.539 0.74 0 C-N-CA 123.404 2.736 . . . . 20.0 110.933 177.66 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 112.523 0.564 . . . . 20.0 112.523 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -64.27 -34.61 78.51 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.597 0.759 . . . . 20.0 111.95 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.14 -46.18 72.18 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.135 0.42 . . . . 20.0 112.135 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -67.08 -42.37 84.78 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.511 0.596 . . . . 20.0 111.958 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -53.91 -47.69 70.92 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.79 0.436 . . . . 20.0 111.408 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.07 -41.78 97.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.929 0.714 . . . . 20.0 112.929 171.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -54.77 -42.62 71.93 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.514 1.126 . . . . 20.0 112.904 177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.27 -6.97 38.68 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.288 1.435 . . . . 20.0 113.822 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.7 2.89 37.25 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.499 1.523 . . . . 20.0 115.461 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 45.68 -109.39 0.32 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.566 2.031 . . . . 20.0 114.066 -178.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -54.88 -34.04 84.21 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.799 2.333 . . . . 20.0 113.681 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 m -66.6 -29.78 69.91 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.514 0.725 . . . . 20.0 112.819 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.27 -18.32 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.326 1.05 . . . . 20.0 112.704 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.93 5.69 53.37 Favored Glycine 0 CA--C 1.539 1.553 0 C-N-CA 124.755 1.169 . . . . 20.0 115.461 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -78.82 132.98 62.79 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.183 1.393 . . . . 20.0 110.548 178.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -41.94 121.65 1.85 Allowed 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.452 3.435 . . . . 20.0 114.183 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -67.32 128.58 18.62 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.321 2.681 . . . . 20.0 112.057 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo . . . . . 0 CA--C 1.54 0.799 0 C-N-CA 123.033 2.488 . . . . 20.0 111.024 176.359 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.251 0 N-CA-C 118.191 2.663 . . . . 20.0 118.191 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.71 -33.95 73.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.821 2.048 . . . . 20.0 114.117 -170.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.9 87.44 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.773 -0.579 . . . . 20.0 111.103 174.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.65 -45.13 88.06 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.554 0.741 . . . . 20.0 111.137 175.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.2 t90 -50.15 -48.8 53.65 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.807 0.843 . . . . 20.0 111.67 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.35 -54.44 43.71 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 118.487 -0.768 . . . . 20.0 112.099 171.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -52.49 -37.56 57.52 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.081 1.141 . . . . 20.0 114.081 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -71.66 -11.88 61.06 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.994 1.109 . . . . 20.0 113.994 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.98 22.31 3.93 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.683 1.135 . . . . 20.0 114.076 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.79 -129.66 45.2 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 118.227 1.013 . . . . 20.0 111.095 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.76 -15.58 37.15 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.469 2.113 . . . . 20.0 112.696 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 t -62.52 -15.39 50.23 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.488 0.921 . . . . 20.0 113.488 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -77.69 -10.42 59.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.482 1.513 . . . . 20.0 113.55 177.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.12 12.4 84.66 Favored Glycine 0 CA--C 1.538 1.474 0 CA-C-N 119.104 0.866 . . . . 20.0 114.922 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.17 126.48 29.59 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.869 1.668 . . . . 20.0 110.516 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -52.13 140.74 50.12 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.387 2.725 . . . . 20.0 113.282 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.81 126.75 17.22 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.437 2.758 . . . . 20.0 112.171 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo . . . . . 0 CA--C 1.548 1.179 0 C-N-CA 123.294 2.662 . . . . 20.0 111.889 177.539 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 113.334 0.864 . . . . 20.0 113.334 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -65.17 -38.82 91.77 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.627 0.771 . . . . 20.0 112.586 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.49 -44.54 85.03 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.802 0.728 . . . . 20.0 112.092 172.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.5 -43.0 77.78 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.967 -0.458 . . . . 20.0 111.67 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -51.88 -48.05 64.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.354 0.661 . . . . 20.0 111.348 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.02 -47.07 87.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 117.948 -1.025 . . . . 20.0 112.806 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -52.97 -40.8 64.0 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.704 1.138 . . . . 20.0 112.816 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -73.16 19.34 0.09 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 125.06 1.344 . . . . 20.0 113.616 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 26.13 47.96 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 126.562 2.03 . . . . 20.0 113.091 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.64 -115.97 4.36 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.77 1.176 . . . . 20.0 111.241 -170.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.75 -9.21 19.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.039 1.826 . . . . 20.0 113.504 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -59.8 -27.82 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.798 1.407 . . . . 20.0 114.798 -173.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -6.09 58.02 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.174 1.39 . . . . 20.0 113.165 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.01 -12.51 42.83 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.755 1.169 . . . . 20.0 115.511 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -58.98 119.42 37.79 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 125.589 1.556 . . . . 20.0 111.037 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.09 135.08 58.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.123 2.549 . . . . 20.0 112.783 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -63.51 139.26 69.46 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.545 2.163 . . . . 20.0 112.635 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo . . . . . 0 CA--C 1.538 0.713 0 C-N-CA 123.379 2.719 . . . . 20.0 111.056 176.12 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.789 0 N-CA-C 115.734 1.754 . . . . 20.0 115.734 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.66 -32.47 69.13 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.033 1.333 . . . . 20.0 113.359 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.13 -45.38 94.91 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.269 0.628 . . . . 20.0 111.06 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -68.61 -42.79 77.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.186 -0.435 . . . . 20.0 111.364 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -51.04 -49.84 59.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.329 0.652 . . . . 20.0 111.628 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.18 -47.74 84.68 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.97 0.73 . . . . 20.0 112.97 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.14 -38.67 65.73 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.152 0.887 . . . . 20.0 112.883 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -78.46 18.86 0.51 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.749 1.62 . . . . 20.0 113.549 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.12 23.61 37.33 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.589 1.566 . . . . 20.0 113.626 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.24 -116.93 7.49 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.861 1.22 . . . . 20.0 110.978 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.06 -9.89 20.88 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.106 1.871 . . . . 20.0 113.541 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 t -56.62 -36.64 69.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.536 1.062 . . . . 20.0 113.427 -175.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -8.01 52.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.384 1.473 . . . . 20.0 113.97 176.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.98 2.94 59.07 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.663 1.12 . . . . 20.0 115.248 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -74.11 133.82 78.08 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.029 1.332 . . . . 20.0 110.939 179.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -44.49 121.2 3.09 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.334 3.356 . . . . 20.0 113.634 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.53 118.38 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.229 2.619 . . . . 20.0 110.735 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 CA--C 1.537 0.668 0 C-N-CA 121.612 1.541 . . . . 20.0 110.511 173.655 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.404 0.891 . . . . 20.0 113.404 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -61.17 -39.89 91.84 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.709 1.204 . . . . 20.0 112.599 -172.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.83 78.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.885 0.874 . . . . 20.0 111.637 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -71.04 -41.83 70.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.161 0.584 . . . . 20.0 111.27 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.8 t90 -51.05 -48.59 61.51 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.836 0.854 . . . . 20.0 111.603 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.75 -43.21 94.39 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 118.723 -0.656 . . . . 20.0 112.65 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -57.18 -35.69 69.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.22 0.918 . . . . 20.0 113.366 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -73.42 13.31 0.47 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.304 1.224 . . . . 20.0 114.304 171.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 21.3 59.95 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.16 -1.587 . . . . 20.0 112.81 -175.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.3 -120.54 16.22 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.246 1.403 . . . . 20.0 111.805 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.7 -10.22 20.04 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.391 2.061 . . . . 20.0 113.208 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 t -72.94 -19.86 61.17 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.93 1.085 . . . . 20.0 113.93 -171.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.2 m -92.85 14.94 15.91 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.653 1.181 . . . . 20.0 113.969 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.48 14.36 74.67 Favored Glycine 0 CA--C 1.536 1.38 0 O-C-N 121.17 -0.956 . . . . 20.0 114.422 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -104.02 126.81 30.72 Favored Pre-proline 0 C--N 1.35 0.614 0 C-N-CA 125.099 1.36 . . . . 20.0 110.078 -171.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.0 144.5 47.59 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.241 1.961 . . . . 20.0 111.473 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.74 136.4 35.71 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.693 2.262 . . . . 20.0 111.779 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo . . . . . 0 CA--C 1.541 0.839 0 C-N-CA 123.767 2.978 . . . . 20.0 110.948 178.061 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.811 0 N-CA-C 113.218 0.822 . . . . 20.0 113.218 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -56.55 -42.1 77.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.33 1.452 . . . . 20.0 113.724 -174.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -48.82 74.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.054 0.942 . . . . 20.0 111.731 174.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.39 -43.47 81.27 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.661 0.384 . . . . 20.0 111.419 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -50.72 -50.48 55.17 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.958 0.903 . . . . 20.0 111.561 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.51 -44.46 97.04 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.638 0.607 . . . . 20.0 112.638 173.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -57.52 -34.92 69.6 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 20.0 113.572 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.82 -6.13 47.32 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 172.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.92 11.05 29.09 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.79 1.186 . . . . 20.0 114.224 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.68 -109.5 0.83 Allowed Glycine 0 CA--C 1.533 1.199 0 C-N-CA 126.523 2.011 . . . . 20.0 113.168 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -54.91 -31.66 74.44 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.713 2.275 . . . . 20.0 113.772 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -56.8 -38.07 72.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.163 0.985 . . . . 20.0 112.271 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -18.21 63.02 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.282 1.433 . . . . 20.0 113.635 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.99 3.73 12.09 Favored Glycine 0 CA--C 1.541 1.713 0 C-N-CA 124.945 1.259 . . . . 20.0 115.905 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 136.53 71.3 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.553 1.541 . . . . 20.0 110.003 177.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -45.36 120.91 3.44 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.177 3.251 . . . . 20.0 113.561 168.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.76 133.21 25.01 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.86 2.373 . . . . 20.0 111.943 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo . . . . . 0 CA--C 1.54 0.784 0 C-N-CA 123.351 2.7 . . . . 20.0 109.894 173.079 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 113.195 0.813 . . . . 20.0 113.195 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.71 -34.69 67.29 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.356 -0.84 . . . . 20.0 112.135 -170.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.57 70.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.43 0.692 . . . . 20.0 110.852 172.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -65.83 -41.26 92.01 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.825 0.85 . . . . 20.0 112.034 177.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -49.75 -51.47 38.78 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.399 0.545 . . . . 20.0 111.309 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.07 -50.37 72.23 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.853 -0.594 . . . . 20.0 112.063 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.8 tptp -56.34 -37.09 69.53 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.348 1.24 . . . . 20.0 114.348 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.32 -7.14 47.92 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.817 1.247 . . . . 20.0 114.357 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.49 23.02 4.57 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.419 1.009 . . . . 20.0 113.917 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.09 -127.74 43.95 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 118.197 0.999 . . . . 20.0 111.61 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.61 -14.69 36.93 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.077 2.518 . . . . 20.0 113.399 -174.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.6 m -70.44 -1.86 12.07 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.933 1.086 . . . . 20.0 113.933 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 m -91.63 6.04 47.33 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.998 1.719 . . . . 20.0 113.666 -170.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.9 12.99 79.07 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.552 1.072 . . . . 20.0 114.882 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -127.35 122.28 22.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.572 1.949 . . . . 20.0 110.679 -175.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.68 150.78 21.03 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.241 2.627 . . . . 20.0 113.784 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.22 115.06 2.76 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.083 3.189 . . . . 20.0 112.242 176.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo . . . . . 0 CA--C 1.54 0.82 0 C-N-CA 123.363 2.709 . . . . 20.0 110.839 179.73 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.826 0 N-CA-C 114.389 1.255 . . . . 20.0 114.389 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -57.91 -43.04 85.94 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.305 1.442 . . . . 20.0 113.62 -171.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.08 -45.03 79.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.834 0.853 . . . . 20.0 111.873 173.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -42.99 69.72 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.841 0.856 . . . . 20.0 111.661 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -51.07 -49.82 59.9 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.209 1.404 . . . . 20.0 111.645 174.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.93 -44.78 96.07 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.026 0.53 . . . . 20.0 112.138 173.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -56.08 -41.25 74.86 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.603 1.161 . . . . 20.0 112.943 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -69.7 -8.32 46.8 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.746 1.218 . . . . 20.0 113.949 174.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.04 8.21 39.54 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.897 1.237 . . . . 20.0 115.303 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 48.33 -110.0 0.6 Allowed Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.539 2.019 . . . . 20.0 113.814 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.74 -28.53 67.07 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.796 2.33 . . . . 20.0 114.029 176.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 t -69.77 -29.96 67.41 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.664 0.786 . . . . 20.0 112.942 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.73 -21.25 38.03 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.535 1.134 . . . . 20.0 112.622 -176.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.03 -14.43 20.65 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.856 1.693 . . . . 20.0 115.665 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 129.48 92.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 118.875 1.337 . . . . 20.0 111.029 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.54 135.17 60.7 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.08 2.52 . . . . 20.0 112.669 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.37 134.91 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.672 2.248 . . . . 20.0 112.291 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo . . . . . 0 CA--C 1.538 0.718 0 C-N-CA 123.603 2.869 . . . . 20.0 110.878 177.616 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.105 0 N-CA-C 116.27 1.952 . . . . 20.0 116.27 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -63.04 -36.79 84.75 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 113.823 1.045 . . . . 20.0 113.823 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.7 88.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.827 -0.546 . . . . 20.0 111.109 174.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -68.07 -42.39 80.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.003 0.521 . . . . 20.0 111.779 175.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -49.92 -47.79 52.1 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.237 0.615 . . . . 20.0 112.068 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.2 -44.89 94.08 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.318 0.858 . . . . 20.0 113.318 174.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -53.49 -39.45 64.56 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.372 1.069 . . . . 20.0 113.023 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.94 16.24 0.32 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 124.658 1.183 . . . . 20.0 114.037 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.63 27.98 40.65 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 120.027 -1.67 . . . . 20.0 112.662 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.4 -118.13 11.74 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.531 1.539 . . . . 20.0 111.985 -176.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -75.02 -7.07 18.82 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.392 2.061 . . . . 20.0 113.178 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -56.65 -34.84 67.73 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.701 1.2 . . . . 20.0 113.367 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.11 -8.35 37.47 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.612 1.565 . . . . 20.0 114.736 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.86 3.33 90.52 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-N 119.219 0.918 . . . . 20.0 114.437 -173.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -89.5 134.29 32.88 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 124.734 1.214 . . . . 20.0 110.477 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -72.3 152.81 55.95 Favored 'Trans proline' 0 CA--C 1.547 1.154 0 C-N-CA 122.097 1.865 . . . . 20.0 112.314 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.62 124.41 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.97 3.113 . . . . 20.0 111.99 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.542 0.885 0 C-N-CA 123.373 2.715 . . . . 20.0 112.085 -178.297 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 113.297 0.851 . . . . 20.0 113.297 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.33 -39.64 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.403 1.081 . . . . 20.0 111.771 -175.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.58 85.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.242 0.617 . . . . 20.0 111.836 173.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -44.83 86.47 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.291 0.636 . . . . 20.0 111.182 176.019 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -52.19 -46.91 65.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.024 0.529 . . . . 20.0 112.123 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -41.13 98.73 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.957 0.725 . . . . 20.0 112.957 174.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -39.66 66.97 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.133 0.973 . . . . 20.0 112.878 177.697 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -82.96 25.75 0.66 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.547 1.539 . . . . 20.0 113.988 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.71 27.31 59.12 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.938 1.256 . . . . 20.0 113.031 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.92 -115.39 6.41 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.22 1.39 . . . . 20.0 111.465 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -77.24 -5.96 16.12 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 122.292 1.994 . . . . 20.0 113.49 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.3 m -58.22 -34.06 70.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.63 1.172 . . . . 20.0 113.625 -173.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -5.03 44.74 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.403 1.881 . . . . 20.0 113.642 176.603 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.66 8.14 86.07 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.495 1.043 . . . . 20.0 114.913 -177.676 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -83.41 131.99 51.15 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.69 1.596 . . . . 20.0 110.471 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.09 140.18 48.83 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.005 1.804 . . . . 20.0 111.107 174.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.62 143.23 61.54 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.832 2.355 . . . . 20.0 111.942 178.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo . . . . . 0 CA--C 1.539 0.768 0 C-N-CA 123.344 2.696 . . . . 20.0 110.87 177.047 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.686 0 N-CA-C 112.826 0.676 . . . . 20.0 112.826 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -59.03 -35.36 73.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.608 0.763 . . . . 20.0 112.472 177.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.63 88.6 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.325 0.65 . . . . 20.0 111.734 176.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.85 -42.3 63.88 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.975 0.51 . . . . 20.0 111.195 175.372 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.7 t90 -54.5 -44.14 72.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.798 . . . . 20.0 112.103 177.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -62.02 -39.22 91.56 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.596 -0.69 . . . . 20.0 112.652 174.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -30.44 63.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.083 1.353 . . . . 20.0 112.323 176.677 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -85.73 18.57 2.82 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.688 1.195 . . . . 20.0 113.018 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.82 27.38 67.05 Favored Glycine 0 C--N 1.348 1.204 0 C-N-CA 125.796 1.665 . . . . 20.0 113.003 -173.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.81 -118.44 14.67 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.185 0.898 . . . . 20.0 111.462 -176.181 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -81.3 6.08 5.83 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.05 2.5 . . . . 20.0 113.677 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.3 p -68.87 -33.96 74.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.054 1.297 . . . . 20.0 113.468 -177.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -10.29 59.61 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.148 0.979 . . . . 20.0 113.031 177.285 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.09 16.26 79.04 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 123.771 0.7 . . . . 20.0 114.025 -176.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.16 133.58 31.5 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 125.338 1.455 . . . . 20.0 110.927 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.66 135.18 37.78 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.095 1.863 . . . . 20.0 111.392 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.0 136.44 65.51 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.61 2.874 . . . . 20.0 112.261 177.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo . . . . . 0 CA--C 1.539 0.735 0 C-N-CA 123.778 2.985 . . . . 20.0 111.39 -179.248 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 113.555 0.946 . . . . 20.0 113.555 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.83 -37.5 87.6 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.466 1.106 . . . . 20.0 113.18 -172.385 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.33 -47.04 82.58 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.352 0.661 . . . . 20.0 111.294 175.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -67.02 -42.31 85.14 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.648 0.779 . . . . 20.0 111.588 175.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -50.29 -50.84 49.25 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.864 0.866 . . . . 20.0 111.597 175.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.52 -45.19 94.72 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 119.154 -0.45 . . . . 20.0 112.163 173.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -54.09 -39.71 66.6 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.754 1.222 . . . . 20.0 113.095 178.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -75.39 12.64 0.92 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.547 1.539 . . . . 20.0 113.674 177.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.27 27.96 31.86 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 120.423 -1.423 . . . . 20.0 112.762 -176.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.19 -117.25 10.46 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.567 1.556 . . . . 20.0 111.882 -177.207 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.98 -7.4 19.15 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.404 2.069 . . . . 20.0 113.364 -179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.2 m -54.96 -34.24 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.772 1.229 . . . . 20.0 113.505 -174.64 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.02 -9.42 52.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.68 1.992 . . . . 20.0 114.474 176.248 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.14 8.96 87.01 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.086 0.857 . . . . 20.0 114.466 -174.127 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -92.35 131.23 35.04 Favored Pre-proline 0 CA--C 1.539 0.558 0 C-N-CA 125.017 1.327 . . . . 20.0 110.628 178.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -65.34 149.74 87.96 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 121.938 1.758 . . . . 20.0 112.176 174.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.45 128.34 16.17 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.827 3.018 . . . . 20.0 112.068 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo . . . . . 0 CA--C 1.54 0.815 0 C-N-CA 123.523 2.815 . . . . 20.0 111.185 -178.653 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.594 1.331 . . . . 20.0 114.594 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.37 -37.62 85.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.694 1.198 . . . . 20.0 113.438 -174.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.24 -44.75 88.41 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.314 0.646 . . . . 20.0 111.249 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -66.75 -41.31 88.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.006 0.522 . . . . 20.0 111.56 175.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 t90 -53.52 -49.45 67.56 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.215 0.461 . . . . 20.0 111.751 174.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.53 -40.95 98.43 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 118.585 -0.721 . . . . 20.0 112.923 174.421 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -53.55 -36.09 61.45 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.039 1.126 . . . . 20.0 114.039 176.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -79.77 10.83 3.66 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.728 1.211 . . . . 20.0 113.642 175.792 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.45 25.75 32.3 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 120.51 -1.369 . . . . 20.0 112.698 -176.319 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.39 -114.93 6.0 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.251 1.405 . . . . 20.0 111.772 -177.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.17 -6.51 15.76 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.261 1.974 . . . . 20.0 113.472 -179.553 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -56.59 -40.29 75.02 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.58 1.082 . . . . 20.0 113.478 -175.352 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -7.68 21.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 127.409 2.284 . . . . 20.0 114.909 174.364 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.26 10.94 84.41 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.714 1.143 . . . . 20.0 114.481 -175.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -90.44 134.34 31.25 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 125.322 1.449 . . . . 20.0 110.628 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.71 143.77 57.33 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.037 1.825 . . . . 20.0 111.582 178.143 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.04 141.72 49.0 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.05 2.5 . . . . 20.0 111.482 177.264 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 CA--C 1.538 0.686 0 C-N-CA 122.895 2.397 . . . . 20.0 111.003 177.166 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.658 1.355 . . . . 20.0 114.658 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.06 -37.63 85.71 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.001 1.32 . . . . 20.0 113.299 -172.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.18 88.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.352 0.661 . . . . 20.0 111.48 174.043 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -69.27 -42.32 75.69 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.457 0.703 . . . . 20.0 111.512 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -49.82 -51.64 38.29 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.868 0.867 . . . . 20.0 111.851 172.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.79 -46.02 90.5 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 118.822 -0.609 . . . . 20.0 112.545 173.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -52.68 -43.28 65.47 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.844 0.858 . . . . 20.0 113.075 175.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -71.25 17.03 0.08 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.298 1.439 . . . . 20.0 114.01 175.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.68 21.28 56.47 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 120.007 -1.683 . . . . 20.0 113.163 -178.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.99 -120.53 15.34 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.364 1.459 . . . . 20.0 111.706 -177.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.44 -9.13 21.36 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.351 2.034 . . . . 20.0 113.388 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 t -76.07 -12.69 60.17 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.442 1.275 . . . . 20.0 114.442 -171.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 m -95.3 15.74 18.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.41 1.084 . . . . 20.0 113.885 179.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.26 16.41 73.25 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.261 -0.9 . . . . 20.0 114.088 177.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -112.91 128.05 26.09 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 125.485 1.514 . . . . 20.0 110.429 -170.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.35 146.68 51.17 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.156 1.904 . . . . 20.0 111.696 -176.175 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.84 130.96 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.22 2.613 . . . . 20.0 112.091 178.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.536 0.624 0 C-N-CA 123.436 2.757 . . . . 20.0 110.379 178.011 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 114.142 1.164 . . . . 20.0 114.142 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.35 -35.37 71.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.99 0.916 . . . . 20.0 113.324 -176.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.26 -42.11 76.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.386 1.074 . . . . 20.0 112.223 173.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -73.54 -40.78 63.73 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.128 0.571 . . . . 20.0 111.126 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -53.93 -47.69 70.97 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.466 0.706 . . . . 20.0 112.242 175.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.73 -39.69 81.6 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.853 0.686 . . . . 20.0 112.853 174.585 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -34.08 69.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.038 1.335 . . . . 20.0 112.742 177.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -84.09 24.57 0.92 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.292 1.837 . . . . 20.0 113.241 174.237 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.06 24.63 76.22 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 120.931 -1.106 . . . . 20.0 112.848 -179.092 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.84 -112.7 2.98 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.458 1.504 . . . . 20.0 111.495 -174.543 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.85 -10.48 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.075 1.85 . . . . 20.0 113.255 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.1 t -58.09 -42.67 86.1 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.37 0.986 . . . . 20.0 113.372 -174.473 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.9 m -70.73 3.0 3.5 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.887 1.439 . . . . 20.0 114.887 174.539 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.0 9.61 85.28 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.188 1.358 . . . . 20.0 114.547 178.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -89.12 129.33 48.38 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.538 1.935 . . . . 20.0 109.974 -179.203 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.21 146.65 76.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.857 1.705 . . . . 20.0 111.201 176.302 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.46 134.03 31.97 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.922 2.414 . . . . 20.0 111.746 179.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 CA--C 1.539 0.755 0 C-N-CA 123.324 2.683 . . . . 20.0 110.871 176.632 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.94 0 N-CA-C 113.345 0.869 . . . . 20.0 113.345 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.01 -38.79 87.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.602 1.161 . . . . 20.0 113.075 -173.449 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.37 -33.01 73.89 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.793 0.837 . . . . 20.0 112.718 176.303 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -76.76 -43.69 35.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.633 0.773 . . . . 20.0 110.673 172.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -50.02 -50.44 47.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.379 0.672 . . . . 20.0 111.746 175.666 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.54 -39.04 89.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.092 0.775 . . . . 20.0 113.092 173.714 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.09 -41.46 78.93 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.608 1.163 . . . . 20.0 112.338 177.207 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -79.04 18.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.595 1.558 . . . . 20.0 114.151 176.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.76 22.11 54.11 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.825 1.202 . . . . 20.0 113.489 178.671 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.82 -116.25 8.73 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.525 1.059 . . . . 20.0 110.751 -175.359 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.69 -10.77 17.06 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.059 1.839 . . . . 20.0 113.646 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.4 m -58.74 -30.04 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.021 1.282 . . . . 20.0 114.196 -175.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.19 -3.46 39.69 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.302 1.441 . . . . 20.0 113.562 175.502 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.43 5.88 83.02 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 119.548 1.067 . . . . 20.0 114.489 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -83.09 130.82 55.76 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 126.759 2.023 . . . . 20.0 110.165 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.06 143.83 67.12 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.053 1.835 . . . . 20.0 111.397 174.692 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.95 134.76 33.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.023 2.482 . . . . 20.0 111.568 178.542 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo . . . . . 0 CA--C 1.536 0.615 0 C-N-CA 123.111 2.541 . . . . 20.0 110.826 177.339 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.23 0 N-CA-C 116.949 2.203 . . . . 20.0 116.949 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -61.21 -41.4 96.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.789 1.635 . . . . 20.0 113.674 -171.33 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.72 80.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.528 0.731 . . . . 20.0 111.739 174.607 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -68.67 -40.63 80.07 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.471 0.708 . . . . 20.0 111.478 177.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -53.7 -51.01 64.62 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.276 0.63 . . . . 20.0 111.969 171.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.97 -42.25 89.49 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.633 -0.667 . . . . 20.0 112.357 174.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -18.56 48.6 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.225 1.565 . . . . 20.0 115.225 177.0 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -95.89 20.1 10.46 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.302 2.241 . . . . 20.0 112.152 172.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.77 24.09 68.07 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 120.734 -1.229 . . . . 20.0 112.709 -177.187 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.51 -114.71 5.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.556 1.074 . . . . 20.0 111.279 -174.177 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -76.83 -9.67 18.23 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 121.935 1.757 . . . . 20.0 113.408 -178.128 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -32.8 70.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.499 1.296 . . . . 20.0 114.499 -175.361 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -79.12 11.03 3.01 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.998 1.11 . . . . 20.0 113.998 175.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.3 17.44 79.68 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.057 -1.027 . . . . 20.0 113.984 177.262 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -109.56 131.74 21.72 Favored Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 125.193 1.397 . . . . 20.0 110.238 -172.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -72.26 151.17 54.24 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.994 1.796 . . . . 20.0 111.833 -176.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.22 125.67 12.71 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.451 2.767 . . . . 20.0 111.638 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo . . . . . 0 CA--C 1.541 0.841 0 C-N-CA 123.288 2.658 . . . . 20.0 111.66 177.715 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.3 -40.71 94.17 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.553 0.741 . . . . 20.0 112.056 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.07 -38.48 91.35 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.0 0.818 . . . . 20.0 112.229 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.48 -48.63 74.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.213 0.605 . . . . 20.0 110.813 173.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -67.27 -42.65 83.51 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.253 0.621 . . . . 20.0 112.117 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -47.3 -50.31 21.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.155 1.382 . . . . 20.0 111.984 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.83 -46.23 85.99 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.301 -0.857 . . . . 20.0 112.521 173.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -54.25 -44.17 71.56 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.389 0.995 . . . . 20.0 113.107 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.2 -18.72 65.53 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.536 0.939 . . . . 20.0 113.536 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.52 9.16 10.47 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.869 1.223 . . . . 20.0 115.17 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.16 -112.44 1.3 Allowed Glycine 0 CA--C 1.535 1.315 0 C-N-CA 127.258 2.361 . . . . 20.0 113.695 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.18 -30.4 60.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.246 2.631 . . . . 20.0 113.88 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -60.26 -38.58 83.94 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.007 1.323 . . . . 20.0 111.847 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.42 -18.3 45.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 126.472 1.909 . . . . 20.0 113.229 -174.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.57 -13.64 1.58 Allowed Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.938 1.733 . . . . 20.0 116.368 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -54.66 126.52 57.3 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.077 1.438 . . . . 20.0 111.229 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -52.59 129.71 33.39 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.279 2.653 . . . . 20.0 112.809 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -64.84 140.09 65.37 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.289 1.993 . . . . 20.0 111.941 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.17 114.91 3.87 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.244 2.629 . . . . 20.0 110.75 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 39.9 m . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.11 -1.424 . . . . 20.0 111.823 169.141 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 119.098 -0.477 . . . . 20.0 111.162 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.58 -32.0 71.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.463 0.542 . . . . 20.0 112.463 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -63.7 -37.27 86.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.256 0.622 . . . . 20.0 112.158 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.89 79.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.718 0.807 . . . . 20.0 111.032 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -69.75 -38.69 76.89 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.348 0.499 . . . . 20.0 112.348 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 t90 -51.17 -52.59 42.73 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.213 1.005 . . . . 20.0 111.451 174.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.4 -44.42 96.48 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.693 0.627 . . . . 20.0 112.693 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.45 57.79 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.517 1.303 . . . . 20.0 114.517 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.66 15.81 19.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.154 0.982 . . . . 20.0 112.941 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.12 20.98 37.01 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.494 1.045 . . . . 20.0 112.96 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.15 -114.36 3.64 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.197 1.855 . . . . 20.0 111.495 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -52.65 -28.78 38.65 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.092 3.195 . . . . 20.0 114.205 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -54.43 -29.28 48.84 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.079 1.351 . . . . 20.0 112.47 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -20.62 62.95 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.938 1.695 . . . . 20.0 113.55 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.17 17.12 65.49 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 124.703 1.145 . . . . 20.0 115.734 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 139.02 21.22 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 125.36 1.464 . . . . 20.0 111.167 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -52.55 129.38 31.84 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 123.732 2.955 . . . . 20.0 113.124 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -67.23 133.82 31.81 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.721 2.281 . . . . 20.0 111.912 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -77.4 81.98 2.5 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.797 2.998 . . . . 20.0 111.348 -178.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.249 1.052 0 CA-C-O 116.726 -1.606 . . . . 20.0 111.989 170.449 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 112.921 0.712 . . . . 20.0 112.921 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.12 14.72 23.77 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.284 1.433 . . . . 20.0 112.576 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -64.97 -38.83 92.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.74 1.616 . . . . 20.0 112.503 -176.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.75 -48.16 72.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.763 0.825 . . . . 20.0 111.013 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.32 -43.09 87.17 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.181 0.592 . . . . 20.0 111.68 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 49.4 t90 -53.28 -47.55 69.07 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.045 0.938 . . . . 20.0 112.041 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.99 -46.66 89.85 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 119.111 -0.471 . . . . 20.0 111.746 171.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.814 1.246 . . . . 20.0 113.899 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -67.69 -17.92 64.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.883 1.273 . . . . 20.0 113.632 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 21.37 4.25 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.345 1.45 . . . . 20.0 114.818 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.99 -129.22 38.05 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.548 1.174 . . . . 20.0 111.151 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.42 -10.33 22.13 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 121.952 1.768 . . . . 20.0 113.07 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -59.68 -34.64 73.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.868 1.267 . . . . 20.0 112.994 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.87 -4.51 38.32 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.015 1.726 . . . . 20.0 113.531 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.95 9.89 86.61 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 124.085 0.85 . . . . 20.0 114.795 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -94.55 133.3 27.11 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 125.379 1.472 . . . . 20.0 110.581 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.92 144.71 65.54 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.041 1.828 . . . . 20.0 111.55 176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.59 136.81 40.54 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.884 2.389 . . . . 20.0 111.302 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.32 136.31 15.81 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.923 2.415 . . . . 20.0 110.647 175.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.253 1.256 0 C-N-CA 128.119 2.568 . . . . 20.0 108.814 176.215 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 16.3 t0 . . . . . 0 N--CA 1.474 0.764 0 CA-C-O 120.702 0.286 . . . . 20.0 110.61 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.64 -36.74 0.14 Allowed 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.299 0.852 . . . . 20.0 113.299 -177.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.58 -33.63 70.18 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.848 0.859 . . . . 20.0 112.853 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.34 -48.56 74.01 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.285 1.034 . . . . 20.0 111.803 171.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -67.46 -43.43 81.06 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.836 0.455 . . . . 20.0 110.838 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -47.9 -50.55 26.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.231 1.012 . . . . 20.0 112.029 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.61 -40.54 92.75 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.192 0.812 . . . . 20.0 113.192 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -32.39 66.96 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.446 1.276 . . . . 20.0 114.446 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -77.78 -12.8 60.01 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.502 0.927 . . . . 20.0 113.502 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.24 7.7 34.7 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.348 1.451 . . . . 20.0 114.382 -175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.85 -113.71 5.31 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.143 -1.365 . . . . 20.0 112.528 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.51 -29.65 60.75 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.38 2.72 . . . . 20.0 114.817 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.9 p -56.39 -39.41 72.92 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.972 0.909 . . . . 20.0 112.887 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -82.8 -16.39 47.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.998 1.319 . . . . 20.0 113.052 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.01 -7.57 3.06 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.379 1.466 . . . . 20.0 116.238 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.48 125.08 51.25 Favored Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 119.195 1.497 . . . . 20.0 110.942 174.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.38 128.43 27.67 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.254 2.636 . . . . 20.0 112.961 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 136.01 42.69 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.383 2.056 . . . . 20.0 111.486 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.46 124.58 9.98 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.789 2.326 . . . . 20.0 109.569 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.1 m . . . . . 0 C--O 1.251 1.153 0 C-N-CA 126.125 1.77 . . . . 20.0 109.712 176.835 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 118.464 -0.779 . . . . 20.0 111.468 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 59.0 2.01 0.23 Allowed 'General case' 0 CA--C 1.554 1.1 0 N-CA-C 117.379 2.363 . . . . 20.0 117.379 178.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.07 -38.12 75.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.277 1.431 . . . . 20.0 113.539 -175.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.96 81.64 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.544 -0.723 . . . . 20.0 111.479 174.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -65.8 -42.71 90.38 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.522 0.729 . . . . 20.0 111.241 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -49.67 -52.14 33.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.161 0.584 . . . . 20.0 111.381 174.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.98 -45.29 94.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.64 0.776 . . . . 20.0 112.796 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -52.56 -41.41 63.53 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.241 1.416 . . . . 20.0 113.184 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.78 8.31 3.82 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.734 1.614 . . . . 20.0 114.183 176.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.31 18.1 53.81 Favored Glycine 0 CA--C 1.532 1.129 0 O-C-N 120.631 -1.293 . . . . 20.0 113.532 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.95 -113.58 3.35 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.377 1.942 . . . . 20.0 112.472 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -53.32 -28.43 43.2 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.284 2.656 . . . . 20.0 113.61 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -55.33 -38.14 68.34 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.951 1.3 . . . . 20.0 112.152 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.7 p -72.44 -9.59 58.73 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 115.324 1.601 . . . . 20.0 115.324 174.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.59 17.43 62.34 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 119.997 1.272 . . . . 20.0 115.569 175.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -106.82 135.24 19.57 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 125.412 1.485 . . . . 20.0 111.316 -176.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.28 125.92 18.98 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.727 2.952 . . . . 20.0 113.281 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.14 135.21 39.49 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.492 2.128 . . . . 20.0 112.309 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.72 98.65 1.16 Allowed 'Trans proline' 0 CA--C 1.537 0.625 0 C-N-CA 123.738 2.958 . . . . 20.0 111.254 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.862 -1.542 . . . . 20.0 111.225 174.171 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 118.08 -0.962 . . . . 20.0 110.841 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -52.88 -32.4 44.85 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.032 1.493 . . . . 20.0 115.032 -171.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -60.38 -32.09 70.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.524 1.13 . . . . 20.0 113.266 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.5 98.76 Favored 'General case' 0 CA--C 1.537 0.442 0 O-C-N 121.891 -0.505 . . . . 20.0 110.683 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -41.9 75.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.248 1.019 . . . . 20.0 111.383 175.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.2 t90 -51.86 -51.14 58.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.633 0.773 . . . . 20.0 112.244 175.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.48 -36.48 82.63 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.943 0.72 . . . . 20.0 112.943 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -60.21 -33.32 72.09 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.683 1.193 . . . . 20.0 113.582 -177.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -83.24 3.68 30.15 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.983 1.313 . . . . 20.0 113.447 173.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.48 16.27 34.97 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 120.95 -1.094 . . . . 20.0 114.023 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.14 -107.02 0.84 Allowed Glycine 0 CA--C 1.533 1.194 0 C-N-CA 126.852 2.168 . . . . 20.0 113.277 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -55.66 -30.04 73.48 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.535 2.157 . . . . 20.0 113.508 172.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -57.35 -36.01 70.66 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.082 1.353 . . . . 20.0 112.473 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -15.85 61.78 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.931 1.692 . . . . 20.0 113.245 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.88 4.14 13.35 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.129 1.347 . . . . 20.0 115.744 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -79.88 136.03 55.0 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 125.672 1.589 . . . . 20.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_exo -44.71 121.21 3.22 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.193 3.262 . . . . 20.0 113.564 173.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.61 124.73 12.78 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.927 2.418 . . . . 20.0 110.589 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.9 156.39 48.01 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 121.887 1.725 . . . . 20.0 110.879 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.9 p . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.153 1.781 . . . . 20.0 111.288 177.015 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 114.313 1.227 . . . . 20.0 114.313 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.0 -31.68 69.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.081 -1.637 . . . . 20.0 113.97 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.29 -32.84 74.36 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.649 0.779 . . . . 20.0 112.623 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.2 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.676 0.791 . . . . 20.0 111.386 173.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -66.59 -45.57 78.81 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.562 -0.732 . . . . 20.0 110.946 175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -48.55 -49.29 36.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.531 0.732 . . . . 20.0 112.63 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.32 -46.54 85.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.006 0.522 . . . . 20.0 112.398 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -55.53 -32.21 62.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.627 1.171 . . . . 20.0 113.637 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -82.16 17.46 1.63 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.168 1.387 . . . . 20.0 114.252 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.61 27.9 37.37 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.331 1.443 . . . . 20.0 112.846 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -115.21 4.78 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.263 1.411 . . . . 20.0 111.697 -172.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.93 -8.61 17.9 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.239 1.959 . . . . 20.0 113.519 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.9 m -55.99 -36.45 67.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.899 1.279 . . . . 20.0 113.764 -171.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.07 -4.31 54.82 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.872 2.069 . . . . 20.0 113.514 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.97 -10.83 31.3 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.237 1.399 . . . . 20.0 115.421 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.79 117.65 22.64 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.196 1.799 . . . . 20.0 111.081 172.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.28 137.02 76.06 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 122.973 2.449 . . . . 20.0 112.969 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -66.36 134.31 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.861 2.374 . . . . 20.0 112.6 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.04 103.16 1.44 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.325 2.683 . . . . 20.0 110.142 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.495 1.918 . . . . 20.0 110.513 179.519 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 114.064 1.135 . . . . 20.0 114.064 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.7 -32.36 70.44 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 119.968 -1.707 . . . . 20.0 114.426 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -63.93 -36.62 84.56 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.228 1.011 . . . . 20.0 112.273 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.62 82.46 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 122.969 0.508 . . . . 20.0 110.495 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -67.05 -38.82 86.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.452 0.538 . . . . 20.0 112.452 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -52.12 -51.55 57.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.886 0.875 . . . . 20.0 111.152 174.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.41 -45.32 94.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 119.094 -0.479 . . . . 20.0 112.159 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -55.39 -38.73 69.25 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.092 1.145 . . . . 20.0 114.092 -178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.0 5.7 4.03 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.356 1.243 . . . . 20.0 114.356 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.59 37.35 Favored Glycine 0 CA--C 1.531 1.084 0 O-C-N 120.616 -1.303 . . . . 20.0 112.913 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.99 -113.16 3.37 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.38 1.943 . . . . 20.0 112.523 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.78 -28.24 56.6 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.494 2.796 . . . . 20.0 114.131 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.5 m -52.47 -37.81 57.95 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 20.0 112.194 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -24.03 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.412 2.285 . . . . 20.0 114.578 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.61 1.66 Allowed Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.505 1.526 . . . . 20.0 116.884 -172.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.45 132.34 95.34 Favored Pre-proline 0 N--CA 1.476 0.838 0 CA-C-N 119.956 1.878 . . . . 20.0 111.281 174.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.5 126.81 18.8 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.503 2.802 . . . . 20.0 112.319 171.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -64.36 138.53 61.0 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.191 1.928 . . . . 20.0 111.501 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.19 150.98 48.58 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.305 2.003 . . . . 20.0 110.764 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t . . . . . 0 C--O 1.253 1.253 0 C-N-CA 125.29 1.436 . . . . 20.0 110.915 174.8 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.2 t70 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 108.634 -0.876 . . . . 20.0 108.634 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.67 -33.81 0.38 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.861 0.864 . . . . 20.0 112.92 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.34 -34.98 71.22 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.881 0.872 . . . . 20.0 112.821 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.73 -50.3 72.64 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 20.0 111.032 174.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -70.26 -33.84 72.08 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.545 0.738 . . . . 20.0 112.389 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -52.19 -55.19 22.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.767 0.827 . . . . 20.0 110.746 172.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.01 -47.15 87.78 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.829 -0.605 . . . . 20.0 112.331 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -39.53 70.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.549 0.74 . . . . 20.0 112.822 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -85.58 32.05 0.58 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.051 1.74 . . . . 20.0 112.379 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.73 27.29 54.4 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.396 0.998 . . . . 20.0 114.138 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.89 -116.92 8.92 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 118.087 0.943 . . . . 20.0 111.498 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.53 -14.95 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.062 1.842 . . . . 20.0 113.534 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -61.29 -23.64 65.84 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.284 1.216 . . . . 20.0 114.284 -174.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -3.23 33.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.733 1.213 . . . . 20.0 113.894 175.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.72 8.38 87.74 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.727 1.149 . . . . 20.0 114.87 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -97.65 127.35 37.89 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 125.664 1.586 . . . . 20.0 110.59 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -52.15 140.04 51.69 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.672 2.248 . . . . 20.0 112.377 172.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.52 130.4 28.12 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 122.634 2.223 . . . . 20.0 111.196 175.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -73.2 156.92 50.92 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.175 1.917 . . . . 20.0 110.799 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.248 0.996 0 C-N-CA 126.033 1.733 . . . . 20.0 109.634 -177.305 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 112.844 0.683 . . . . 20.0 112.844 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.36 -26.86 68.66 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.262 1.025 . . . . 20.0 113.134 175.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.6 -34.91 73.35 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.91 0.884 . . . . 20.0 112.454 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.73 -31.31 72.21 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.8 0.84 . . . . 20.0 112.636 175.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -43.11 20.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.955 0.902 . . . . 20.0 110.571 171.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -48.0 -52.54 19.51 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.513 1.125 . . . . 20.0 112.316 176.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.4 mt -60.73 -39.05 87.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -59.17 -41.49 88.53 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.926 1.69 . . . . 20.0 111.954 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -76.01 28.66 0.11 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 126.683 1.993 . . . . 20.0 114.15 172.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.18 28.28 66.61 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 125.155 1.359 . . . . 20.0 113.698 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.76 -117.09 6.75 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.97 1.271 . . . . 20.0 111.56 -173.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -75.82 -10.81 20.01 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.04 1.827 . . . . 20.0 113.396 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -54.8 -39.58 68.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.308 1.043 . . . . 20.0 113.252 -173.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.7 m -75.81 -8.9 57.99 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.584 1.327 . . . . 20.0 114.584 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.01 -10.72 46.25 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 115.973 1.149 . . . . 20.0 115.973 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -58.7 122.84 64.31 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 118.93 1.365 . . . . 20.0 111.127 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -54.19 136.38 67.85 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.003 2.469 . . . . 20.0 112.931 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.64 130.26 24.45 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.783 2.322 . . . . 20.0 111.752 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -73.03 124.6 9.71 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.727 2.284 . . . . 20.0 109.766 176.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 p . . . . . 0 C--O 1.252 1.231 0 CA-C-O 116.862 -1.542 . . . . 20.0 110.41 175.404 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 N--CA 1.488 1.475 0 N-CA-C 114.741 1.386 . . . . 20.0 114.741 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.44 10.02 13.46 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.54 -1.35 . . . . 20.0 114.194 -174.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.14 -37.63 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.5 1.12 . . . . 20.0 113.458 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.33 -45.44 91.34 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.635 -0.665 . . . . 20.0 111.372 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -66.92 -35.22 79.5 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.408 0.683 . . . . 20.0 111.836 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.7 t90 -58.26 -52.08 67.07 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.191 -0.943 . . . . 20.0 111.268 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -59.14 -44.62 92.06 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.371 0.668 . . . . 20.0 112.657 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -38.06 53.66 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.52 1.128 . . . . 20.0 113.596 176.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -83.63 26.49 0.68 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.956 1.702 . . . . 20.0 113.44 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.08 26.01 65.23 Favored Glycine 0 CA--C 1.531 1.066 0 O-C-N 121.09 -1.006 . . . . 20.0 112.986 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.14 -115.05 4.2 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.078 1.323 . . . . 20.0 111.65 -174.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -75.0 -9.72 20.9 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.209 1.939 . . . . 20.0 113.345 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 t -62.2 -34.01 75.65 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.711 1.004 . . . . 20.0 113.711 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.0 m -78.37 0.14 26.81 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.007 1.114 . . . . 20.0 114.007 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.25 14.23 82.53 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 119.432 1.015 . . . . 20.0 114.939 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -98.43 123.31 50.81 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 126.143 1.777 . . . . 20.0 110.239 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.74 138.63 59.51 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.917 2.411 . . . . 20.0 112.553 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.47 136.3 49.9 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.718 2.279 . . . . 20.0 111.928 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -79.13 115.59 3.53 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.404 2.736 . . . . 20.0 110.933 177.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.5 m . . . . . 0 C--O 1.251 1.145 0 C-N-CA 125.601 1.56 . . . . 20.0 110.996 169.079 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.8 t0 . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 109.305 -0.628 . . . . 20.0 109.305 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.17 -30.74 9.04 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.685 0.794 . . . . 20.0 112.523 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -64.27 -34.61 78.51 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.597 0.759 . . . . 20.0 111.95 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.14 -46.18 72.18 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.135 0.42 . . . . 20.0 112.135 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -67.08 -42.37 84.78 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.511 0.596 . . . . 20.0 111.958 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -53.91 -47.69 70.92 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.79 0.436 . . . . 20.0 111.408 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.07 -41.78 97.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.929 0.714 . . . . 20.0 112.929 171.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -54.77 -42.62 71.93 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.514 1.126 . . . . 20.0 112.904 177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.27 -6.97 38.68 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.288 1.435 . . . . 20.0 113.822 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.7 2.89 37.25 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.499 1.523 . . . . 20.0 115.461 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 45.68 -109.39 0.32 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.566 2.031 . . . . 20.0 114.066 -178.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -54.88 -34.04 84.21 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.799 2.333 . . . . 20.0 113.681 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 m -66.6 -29.78 69.91 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.514 0.725 . . . . 20.0 112.819 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.27 -18.32 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.326 1.05 . . . . 20.0 112.704 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.93 5.69 53.37 Favored Glycine 0 CA--C 1.539 1.553 0 C-N-CA 124.755 1.169 . . . . 20.0 115.461 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -78.82 132.98 62.79 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.183 1.393 . . . . 20.0 110.548 178.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -41.94 121.65 1.85 Allowed 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.452 3.435 . . . . 20.0 114.183 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -67.32 128.58 18.62 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.321 2.681 . . . . 20.0 112.057 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.23 89.3 1.33 Allowed 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.033 2.488 . . . . 20.0 111.024 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p . . . . . 0 C--O 1.258 1.521 0 CA-C-O 114.656 -2.593 . . . . 20.0 110.96 176.85 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.6 t70 . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 117.557 -1.211 . . . . 20.0 108.78 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 51.4 -6.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 118.191 2.663 . . . . 20.0 118.191 -176.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.71 -33.95 73.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.821 2.048 . . . . 20.0 114.117 -170.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.9 87.44 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.773 -0.579 . . . . 20.0 111.103 174.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.65 -45.13 88.06 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.554 0.741 . . . . 20.0 111.137 175.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.2 t90 -50.15 -48.8 53.65 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.807 0.843 . . . . 20.0 111.67 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.35 -54.44 43.71 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 118.487 -0.768 . . . . 20.0 112.099 171.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -52.49 -37.56 57.52 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.081 1.141 . . . . 20.0 114.081 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -71.66 -11.88 61.06 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.994 1.109 . . . . 20.0 113.994 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.98 22.31 3.93 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.683 1.135 . . . . 20.0 114.076 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.79 -129.66 45.2 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 118.227 1.013 . . . . 20.0 111.095 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.76 -15.58 37.15 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.469 2.113 . . . . 20.0 112.696 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 t -62.52 -15.39 50.23 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.488 0.921 . . . . 20.0 113.488 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -77.69 -10.42 59.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.482 1.513 . . . . 20.0 113.55 177.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.12 12.4 84.66 Favored Glycine 0 CA--C 1.538 1.474 0 CA-C-N 119.104 0.866 . . . . 20.0 114.922 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.17 126.48 29.59 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.869 1.668 . . . . 20.0 110.516 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -52.13 140.74 50.12 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.387 2.725 . . . . 20.0 113.282 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.81 126.75 17.22 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.437 2.758 . . . . 20.0 112.171 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.7 64.08 8.81 Favored 'Trans proline' 0 CA--C 1.548 1.179 0 C-N-CA 123.294 2.662 . . . . 20.0 111.889 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 C--O 1.248 1.002 0 C-N-CA 127.209 2.204 . . . . 20.0 110.995 173.345 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 109.802 -0.444 . . . . 20.0 109.802 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.7 -17.08 14.04 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.883 0.873 . . . . 20.0 113.334 172.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -65.17 -38.82 91.77 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.627 0.771 . . . . 20.0 112.586 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.49 -44.54 85.03 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.802 0.728 . . . . 20.0 112.092 172.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.5 -43.0 77.78 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.967 -0.458 . . . . 20.0 111.67 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -51.88 -48.05 64.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.354 0.661 . . . . 20.0 111.348 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.02 -47.07 87.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 117.948 -1.025 . . . . 20.0 112.806 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -52.97 -40.8 64.0 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.704 1.138 . . . . 20.0 112.816 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -73.16 19.34 0.09 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 125.06 1.344 . . . . 20.0 113.616 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 26.13 47.96 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 126.562 2.03 . . . . 20.0 113.091 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.64 -115.97 4.36 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.77 1.176 . . . . 20.0 111.241 -170.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.75 -9.21 19.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.039 1.826 . . . . 20.0 113.504 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -59.8 -27.82 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.798 1.407 . . . . 20.0 114.798 -173.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -6.09 58.02 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.174 1.39 . . . . 20.0 113.165 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.01 -12.51 42.83 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.755 1.169 . . . . 20.0 115.511 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -58.98 119.42 37.79 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 125.589 1.556 . . . . 20.0 111.037 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.09 135.08 58.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.123 2.549 . . . . 20.0 112.783 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -63.51 139.26 69.46 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.545 2.163 . . . . 20.0 112.635 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.72 107.5 2.38 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.379 2.719 . . . . 20.0 111.056 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 C--O 1.247 0.94 0 C-N-CA 125.745 1.618 . . . . 20.0 110.821 176.321 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 118.583 -0.722 . . . . 20.0 111.746 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.18 -27.38 3.54 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.734 1.754 . . . . 20.0 115.734 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.66 -32.47 69.13 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.033 1.333 . . . . 20.0 113.359 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.13 -45.38 94.91 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.269 0.628 . . . . 20.0 111.06 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -68.61 -42.79 77.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.186 -0.435 . . . . 20.0 111.364 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -51.04 -49.84 59.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.329 0.652 . . . . 20.0 111.628 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.18 -47.74 84.68 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.97 0.73 . . . . 20.0 112.97 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.14 -38.67 65.73 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.152 0.887 . . . . 20.0 112.883 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -78.46 18.86 0.51 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.749 1.62 . . . . 20.0 113.549 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.12 23.61 37.33 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.589 1.566 . . . . 20.0 113.626 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.24 -116.93 7.49 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.861 1.22 . . . . 20.0 110.978 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.06 -9.89 20.88 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.106 1.871 . . . . 20.0 113.541 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 t -56.62 -36.64 69.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.536 1.062 . . . . 20.0 113.427 -175.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -8.01 52.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.384 1.473 . . . . 20.0 113.97 176.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.98 2.94 59.07 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.663 1.12 . . . . 20.0 115.248 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -74.11 133.82 78.08 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.029 1.332 . . . . 20.0 110.939 179.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -44.49 121.2 3.09 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.334 3.356 . . . . 20.0 113.634 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.53 118.38 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.229 2.619 . . . . 20.0 110.735 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.3 150.61 47.38 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 121.612 1.541 . . . . 20.0 110.511 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.252 1.219 0 C-N-CA 126.024 1.73 . . . . 20.0 109.459 174.816 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 108.811 -0.811 . . . . 20.0 108.811 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.58 7.6 2.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.467 1.107 . . . . 20.0 113.404 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -61.17 -39.89 91.84 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.709 1.204 . . . . 20.0 112.599 -172.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.83 78.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.885 0.874 . . . . 20.0 111.637 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -71.04 -41.83 70.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.161 0.584 . . . . 20.0 111.27 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.8 t90 -51.05 -48.59 61.51 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.836 0.854 . . . . 20.0 111.603 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.75 -43.21 94.39 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 118.723 -0.656 . . . . 20.0 112.65 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -57.18 -35.69 69.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.22 0.918 . . . . 20.0 113.366 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -73.42 13.31 0.47 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.304 1.224 . . . . 20.0 114.304 171.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 21.3 59.95 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.16 -1.587 . . . . 20.0 112.81 -175.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.3 -120.54 16.22 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.246 1.403 . . . . 20.0 111.805 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.7 -10.22 20.04 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.391 2.061 . . . . 20.0 113.208 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 t -72.94 -19.86 61.17 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.93 1.085 . . . . 20.0 113.93 -171.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.2 m -92.85 14.94 15.91 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.653 1.181 . . . . 20.0 113.969 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.48 14.36 74.67 Favored Glycine 0 CA--C 1.536 1.38 0 O-C-N 121.17 -0.956 . . . . 20.0 114.422 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -104.02 126.81 30.72 Favored Pre-proline 0 C--N 1.35 0.614 0 C-N-CA 125.099 1.36 . . . . 20.0 110.078 -171.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.0 144.5 47.59 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.241 1.961 . . . . 20.0 111.473 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.74 136.4 35.71 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.693 2.262 . . . . 20.0 111.779 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -79.9 72.37 6.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.767 2.978 . . . . 20.0 110.948 178.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 116.791 -1.576 . . . . 20.0 111.272 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 112.534 0.568 . . . . 20.0 112.534 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.65 1.15 55.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.657 1.183 . . . . 20.0 113.218 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -56.55 -42.1 77.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.33 1.452 . . . . 20.0 113.724 -174.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -48.82 74.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.054 0.942 . . . . 20.0 111.731 174.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.39 -43.47 81.27 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.661 0.384 . . . . 20.0 111.419 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -50.72 -50.48 55.17 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.958 0.903 . . . . 20.0 111.561 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.51 -44.46 97.04 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.638 0.607 . . . . 20.0 112.638 173.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -57.52 -34.92 69.6 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 20.0 113.572 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.82 -6.13 47.32 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 172.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.92 11.05 29.09 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.79 1.186 . . . . 20.0 114.224 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.68 -109.5 0.83 Allowed Glycine 0 CA--C 1.533 1.199 0 C-N-CA 126.523 2.011 . . . . 20.0 113.168 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -54.91 -31.66 74.44 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.713 2.275 . . . . 20.0 113.772 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -56.8 -38.07 72.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.163 0.985 . . . . 20.0 112.271 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -18.21 63.02 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.282 1.433 . . . . 20.0 113.635 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.99 3.73 12.09 Favored Glycine 0 CA--C 1.541 1.713 0 C-N-CA 124.945 1.259 . . . . 20.0 115.905 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 136.53 71.3 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.553 1.541 . . . . 20.0 110.003 177.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -45.36 120.91 3.44 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.177 3.251 . . . . 20.0 113.561 168.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.76 133.21 25.01 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.86 2.373 . . . . 20.0 111.943 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -78.27 80.34 3.04 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.351 2.7 . . . . 20.0 109.894 173.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.257 1.478 0 CA-C-O 112.894 -3.431 . . . . 20.0 114.437 176.501 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 21.2 t0 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.699 -0.852 . . . . 20.0 108.699 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.53 7.18 1.7 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.82 1.248 . . . . 20.0 113.195 173.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.71 -34.69 67.29 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.356 -0.84 . . . . 20.0 112.135 -170.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.57 70.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.43 0.692 . . . . 20.0 110.852 172.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -65.83 -41.26 92.01 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.825 0.85 . . . . 20.0 112.034 177.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -49.75 -51.47 38.78 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.399 0.545 . . . . 20.0 111.309 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.07 -50.37 72.23 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.853 -0.594 . . . . 20.0 112.063 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.8 tptp -56.34 -37.09 69.53 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.348 1.24 . . . . 20.0 114.348 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.32 -7.14 47.92 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.817 1.247 . . . . 20.0 114.357 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.49 23.02 4.57 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.419 1.009 . . . . 20.0 113.917 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.09 -127.74 43.95 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 118.197 0.999 . . . . 20.0 111.61 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.61 -14.69 36.93 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.077 2.518 . . . . 20.0 113.399 -174.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.6 m -70.44 -1.86 12.07 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.933 1.086 . . . . 20.0 113.933 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 m -91.63 6.04 47.33 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.998 1.719 . . . . 20.0 113.666 -170.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.9 12.99 79.07 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.552 1.072 . . . . 20.0 114.882 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -127.35 122.28 22.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.572 1.949 . . . . 20.0 110.679 -175.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.68 150.78 21.03 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.241 2.627 . . . . 20.0 113.784 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.22 115.06 2.76 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.083 3.189 . . . . 20.0 112.242 176.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -79.31 65.93 8.82 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.363 2.709 . . . . 20.0 110.839 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.1 t . . . . . 0 C--O 1.257 1.448 0 CA-C-O 112.627 -3.558 . . . . 20.0 114.999 -179.65 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 CA-C-O 118.413 -0.803 . . . . 20.0 112.509 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.75 13.6 12.06 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.389 1.255 . . . . 20.0 114.389 -168.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -57.91 -43.04 85.94 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.305 1.442 . . . . 20.0 113.62 -171.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.08 -45.03 79.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.834 0.853 . . . . 20.0 111.873 173.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -42.99 69.72 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.841 0.856 . . . . 20.0 111.661 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -51.07 -49.82 59.9 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.209 1.404 . . . . 20.0 111.645 174.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.93 -44.78 96.07 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.026 0.53 . . . . 20.0 112.138 173.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -56.08 -41.25 74.86 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.603 1.161 . . . . 20.0 112.943 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -69.7 -8.32 46.8 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.746 1.218 . . . . 20.0 113.949 174.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.04 8.21 39.54 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.897 1.237 . . . . 20.0 115.303 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 48.33 -110.0 0.6 Allowed Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.539 2.019 . . . . 20.0 113.814 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.74 -28.53 67.07 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.796 2.33 . . . . 20.0 114.029 176.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 t -69.77 -29.96 67.41 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.664 0.786 . . . . 20.0 112.942 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.73 -21.25 38.03 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.535 1.134 . . . . 20.0 112.622 -176.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.03 -14.43 20.65 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.856 1.693 . . . . 20.0 115.665 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 129.48 92.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 118.875 1.337 . . . . 20.0 111.029 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.54 135.17 60.7 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.08 2.52 . . . . 20.0 112.669 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.37 134.91 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.672 2.248 . . . . 20.0 112.291 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -79.66 112.61 2.95 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.603 2.869 . . . . 20.0 110.878 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.994 1.718 . . . . 20.0 110.784 179.577 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.475 0.777 0 CA-C-O 118.661 -0.685 . . . . 20.0 109.677 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.86 8.04 5.13 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 116.27 1.952 . . . . 20.0 116.27 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -63.04 -36.79 84.75 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 113.823 1.045 . . . . 20.0 113.823 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.7 88.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.827 -0.546 . . . . 20.0 111.109 174.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -68.07 -42.39 80.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.003 0.521 . . . . 20.0 111.779 175.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -49.92 -47.79 52.1 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.237 0.615 . . . . 20.0 112.068 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.2 -44.89 94.08 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.318 0.858 . . . . 20.0 113.318 174.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -53.49 -39.45 64.56 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.372 1.069 . . . . 20.0 113.023 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.94 16.24 0.32 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 124.658 1.183 . . . . 20.0 114.037 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.63 27.98 40.65 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 120.027 -1.67 . . . . 20.0 112.662 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.4 -118.13 11.74 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.531 1.539 . . . . 20.0 111.985 -176.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -75.02 -7.07 18.82 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.392 2.061 . . . . 20.0 113.178 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -56.65 -34.84 67.73 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.701 1.2 . . . . 20.0 113.367 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.11 -8.35 37.47 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.612 1.565 . . . . 20.0 114.736 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.86 3.33 90.52 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-N 119.219 0.918 . . . . 20.0 114.437 -173.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -89.5 134.29 32.88 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 124.734 1.214 . . . . 20.0 110.477 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -72.3 152.81 55.95 Favored 'Trans proline' 0 CA--C 1.547 1.154 0 C-N-CA 122.097 1.865 . . . . 20.0 112.314 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.62 124.41 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.97 3.113 . . . . 20.0 111.99 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -81.1 88.34 1.39 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.373 2.715 . . . . 20.0 112.085 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 C--O 1.245 0.849 0 C-N-CA 126.15 1.78 . . . . 20.0 111.707 179.442 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 118.266 -0.873 . . . . 20.0 108.868 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.3 -0.02 11.6 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.713 1.205 . . . . 20.0 113.297 177.167 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.33 -39.64 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.403 1.081 . . . . 20.0 111.771 -175.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.58 85.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.242 0.617 . . . . 20.0 111.836 173.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -44.83 86.47 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.291 0.636 . . . . 20.0 111.182 176.019 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -52.19 -46.91 65.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.024 0.529 . . . . 20.0 112.123 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -41.13 98.73 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.957 0.725 . . . . 20.0 112.957 174.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -39.66 66.97 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.133 0.973 . . . . 20.0 112.878 177.697 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -82.96 25.75 0.66 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.547 1.539 . . . . 20.0 113.988 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.71 27.31 59.12 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.938 1.256 . . . . 20.0 113.031 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.92 -115.39 6.41 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.22 1.39 . . . . 20.0 111.465 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -77.24 -5.96 16.12 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 122.292 1.994 . . . . 20.0 113.49 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.3 m -58.22 -34.06 70.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.63 1.172 . . . . 20.0 113.625 -173.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -5.03 44.74 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.403 1.881 . . . . 20.0 113.642 176.603 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.66 8.14 86.07 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.495 1.043 . . . . 20.0 114.913 -177.676 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -83.41 131.99 51.15 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.69 1.596 . . . . 20.0 110.471 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.09 140.18 48.83 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.005 1.804 . . . . 20.0 111.107 174.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.62 143.23 61.54 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.832 2.355 . . . . 20.0 111.942 178.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.51 112.32 3.32 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.344 2.696 . . . . 20.0 110.87 177.047 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 126.944 2.098 . . . . 20.0 110.355 176.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.788 0.292 . . . . 20.0 111.788 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.36 -29.31 70.38 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.826 0.676 . . . . 20.0 112.826 176.681 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -59.03 -35.36 73.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.608 0.763 . . . . 20.0 112.472 177.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.63 88.6 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.325 0.65 . . . . 20.0 111.734 176.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.85 -42.3 63.88 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.975 0.51 . . . . 20.0 111.195 175.372 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.7 t90 -54.5 -44.14 72.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.798 . . . . 20.0 112.103 177.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -62.02 -39.22 91.56 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.596 -0.69 . . . . 20.0 112.652 174.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -30.44 63.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.083 1.353 . . . . 20.0 112.323 176.677 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -85.73 18.57 2.82 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.688 1.195 . . . . 20.0 113.018 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.82 27.38 67.05 Favored Glycine 0 C--N 1.348 1.204 0 C-N-CA 125.796 1.665 . . . . 20.0 113.003 -173.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.81 -118.44 14.67 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.185 0.898 . . . . 20.0 111.462 -176.181 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -81.3 6.08 5.83 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.05 2.5 . . . . 20.0 113.677 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.3 p -68.87 -33.96 74.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.054 1.297 . . . . 20.0 113.468 -177.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -10.29 59.61 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.148 0.979 . . . . 20.0 113.031 177.285 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.09 16.26 79.04 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 123.771 0.7 . . . . 20.0 114.025 -176.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.16 133.58 31.5 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 125.338 1.455 . . . . 20.0 110.927 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.66 135.18 37.78 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.095 1.863 . . . . 20.0 111.392 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.0 136.44 65.51 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.61 2.874 . . . . 20.0 112.261 177.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -82.77 82.76 2.12 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.778 2.985 . . . . 20.0 111.39 -179.248 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 56.5 m . . . . . 0 C--O 1.248 1.006 0 CA-C-O 116.896 -1.526 . . . . 20.0 111.515 -179.327 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 119.24 -0.41 . . . . 20.0 111.105 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.97 4.28 2.5 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.457 1.103 . . . . 20.0 113.555 176.216 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.83 -37.5 87.6 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.466 1.106 . . . . 20.0 113.18 -172.385 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.33 -47.04 82.58 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.352 0.661 . . . . 20.0 111.294 175.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -67.02 -42.31 85.14 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.648 0.779 . . . . 20.0 111.588 175.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -50.29 -50.84 49.25 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.864 0.866 . . . . 20.0 111.597 175.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.52 -45.19 94.72 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 119.154 -0.45 . . . . 20.0 112.163 173.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -54.09 -39.71 66.6 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.754 1.222 . . . . 20.0 113.095 178.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -75.39 12.64 0.92 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.547 1.539 . . . . 20.0 113.674 177.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.27 27.96 31.86 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 120.423 -1.423 . . . . 20.0 112.762 -176.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.19 -117.25 10.46 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.567 1.556 . . . . 20.0 111.882 -177.207 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.98 -7.4 19.15 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.404 2.069 . . . . 20.0 113.364 -179.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.2 m -54.96 -34.24 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.772 1.229 . . . . 20.0 113.505 -174.64 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.02 -9.42 52.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.68 1.992 . . . . 20.0 114.474 176.248 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.14 8.96 87.01 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.086 0.857 . . . . 20.0 114.466 -174.127 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -92.35 131.23 35.04 Favored Pre-proline 0 CA--C 1.539 0.558 0 C-N-CA 125.017 1.327 . . . . 20.0 110.628 178.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -65.34 149.74 87.96 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 121.938 1.758 . . . . 20.0 112.176 174.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.45 128.34 16.17 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.827 3.018 . . . . 20.0 112.068 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -78.04 88.76 1.4 Allowed 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.523 2.815 . . . . 20.0 111.185 -178.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.251 1.173 0 CA-C-O 116.661 -1.637 . . . . 20.0 111.188 177.355 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 117.926 -1.035 . . . . 20.0 111.27 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.06 -0.05 23.21 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.594 1.331 . . . . 20.0 114.594 -172.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.37 -37.62 85.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.694 1.198 . . . . 20.0 113.438 -174.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.24 -44.75 88.41 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.314 0.646 . . . . 20.0 111.249 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -66.75 -41.31 88.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.006 0.522 . . . . 20.0 111.56 175.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 t90 -53.52 -49.45 67.56 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.215 0.461 . . . . 20.0 111.751 174.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.53 -40.95 98.43 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 118.585 -0.721 . . . . 20.0 112.923 174.421 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -53.55 -36.09 61.45 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.039 1.126 . . . . 20.0 114.039 176.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -79.77 10.83 3.66 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.728 1.211 . . . . 20.0 113.642 175.792 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.45 25.75 32.3 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 120.51 -1.369 . . . . 20.0 112.698 -176.319 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.39 -114.93 6.0 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.251 1.405 . . . . 20.0 111.772 -177.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.17 -6.51 15.76 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.261 1.974 . . . . 20.0 113.472 -179.553 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -56.59 -40.29 75.02 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.58 1.082 . . . . 20.0 113.478 -175.352 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -7.68 21.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 127.409 2.284 . . . . 20.0 114.909 174.364 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.26 10.94 84.41 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.714 1.143 . . . . 20.0 114.481 -175.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -90.44 134.34 31.25 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 125.322 1.449 . . . . 20.0 110.628 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.71 143.77 57.33 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.037 1.825 . . . . 20.0 111.582 178.143 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.04 141.72 49.0 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.05 2.5 . . . . 20.0 111.482 177.264 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.07 129.48 10.57 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.895 2.397 . . . . 20.0 111.003 177.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.1 p . . . . . 0 C--O 1.259 1.582 0 CA-C-O 114.816 -2.516 . . . . 20.0 110.641 175.71 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 25.1 p-10 . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 119.147 -0.454 . . . . 20.0 110.94 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.56 5.57 12.69 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.014 1.726 . . . . 20.0 114.658 -171.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.06 -37.63 85.71 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.001 1.32 . . . . 20.0 113.299 -172.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.18 88.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.352 0.661 . . . . 20.0 111.48 174.043 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -69.27 -42.32 75.69 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.457 0.703 . . . . 20.0 111.512 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -49.82 -51.64 38.29 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.868 0.867 . . . . 20.0 111.851 172.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.79 -46.02 90.5 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 118.822 -0.609 . . . . 20.0 112.545 173.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -52.68 -43.28 65.47 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.844 0.858 . . . . 20.0 113.075 175.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -71.25 17.03 0.08 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.298 1.439 . . . . 20.0 114.01 175.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.68 21.28 56.47 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 120.007 -1.683 . . . . 20.0 113.163 -178.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.99 -120.53 15.34 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.364 1.459 . . . . 20.0 111.706 -177.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.44 -9.13 21.36 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.351 2.034 . . . . 20.0 113.388 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 t -76.07 -12.69 60.17 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.442 1.275 . . . . 20.0 114.442 -171.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 m -95.3 15.74 18.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.41 1.084 . . . . 20.0 113.885 179.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.26 16.41 73.25 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.261 -0.9 . . . . 20.0 114.088 177.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -112.91 128.05 26.09 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 125.485 1.514 . . . . 20.0 110.429 -170.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.35 146.68 51.17 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.156 1.904 . . . . 20.0 111.696 -176.175 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.84 130.96 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.22 2.613 . . . . 20.0 112.091 178.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -73.93 96.68 0.94 Allowed 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.436 2.757 . . . . 20.0 110.379 178.011 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 116.889 -1.529 . . . . 20.0 111.205 174.479 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.472 0.64 0 CA-C-O 117.518 -1.23 . . . . 20.0 108.999 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.58 -35.41 7.06 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.142 1.164 . . . . 20.0 114.142 -177.092 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.35 -35.37 71.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.99 0.916 . . . . 20.0 113.324 -176.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.26 -42.11 76.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.386 1.074 . . . . 20.0 112.223 173.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -73.54 -40.78 63.73 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.128 0.571 . . . . 20.0 111.126 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -53.93 -47.69 70.97 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.466 0.706 . . . . 20.0 112.242 175.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.73 -39.69 81.6 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.853 0.686 . . . . 20.0 112.853 174.585 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -34.08 69.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.038 1.335 . . . . 20.0 112.742 177.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -84.09 24.57 0.92 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.292 1.837 . . . . 20.0 113.241 174.237 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.06 24.63 76.22 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 120.931 -1.106 . . . . 20.0 112.848 -179.092 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.84 -112.7 2.98 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.458 1.504 . . . . 20.0 111.495 -174.543 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.85 -10.48 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.075 1.85 . . . . 20.0 113.255 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.1 t -58.09 -42.67 86.1 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.37 0.986 . . . . 20.0 113.372 -174.473 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.9 m -70.73 3.0 3.5 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.887 1.439 . . . . 20.0 114.887 174.539 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.0 9.61 85.28 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.188 1.358 . . . . 20.0 114.547 178.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -89.12 129.33 48.38 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.538 1.935 . . . . 20.0 109.974 -179.203 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.21 146.65 76.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.857 1.705 . . . . 20.0 111.201 176.302 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.46 134.03 31.97 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.922 2.414 . . . . 20.0 111.746 179.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.25 100.64 1.39 Allowed 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.324 2.683 . . . . 20.0 110.871 176.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.2 m . . . . . 0 C--O 1.25 1.08 0 CA-C-O 116.455 -1.736 . . . . 20.0 111.849 167.72 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.07 7.2 2.01 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.271 1.028 . . . . 20.0 113.345 171.807 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.01 -38.79 87.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.602 1.161 . . . . 20.0 113.075 -173.449 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.37 -33.01 73.89 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.793 0.837 . . . . 20.0 112.718 176.303 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -76.76 -43.69 35.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.633 0.773 . . . . 20.0 110.673 172.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -50.02 -50.44 47.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.379 0.672 . . . . 20.0 111.746 175.666 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.54 -39.04 89.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.092 0.775 . . . . 20.0 113.092 173.714 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.09 -41.46 78.93 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.608 1.163 . . . . 20.0 112.338 177.207 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -79.04 18.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.595 1.558 . . . . 20.0 114.151 176.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.76 22.11 54.11 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.825 1.202 . . . . 20.0 113.489 178.671 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.82 -116.25 8.73 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.525 1.059 . . . . 20.0 110.751 -175.359 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.69 -10.77 17.06 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.059 1.839 . . . . 20.0 113.646 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.4 m -58.74 -30.04 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.021 1.282 . . . . 20.0 114.196 -175.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.19 -3.46 39.69 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.302 1.441 . . . . 20.0 113.562 175.502 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.43 5.88 83.02 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 119.548 1.067 . . . . 20.0 114.489 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -83.09 130.82 55.76 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 126.759 2.023 . . . . 20.0 110.165 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.06 143.83 67.12 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.053 1.835 . . . . 20.0 111.397 174.692 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.95 134.76 33.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.023 2.482 . . . . 20.0 111.568 178.542 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.12 127.46 9.26 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.111 2.541 . . . . 20.0 110.826 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.253 1.249 0 CA-C-O 113.08 -3.343 . . . . 20.0 113.57 172.312 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 117.897 -1.049 . . . . 20.0 111.161 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.12 5.29 0.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 116.949 2.203 . . . . 20.0 116.949 178.263 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -61.21 -41.4 96.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.789 1.635 . . . . 20.0 113.674 -171.33 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.72 80.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.528 0.731 . . . . 20.0 111.739 174.607 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -68.67 -40.63 80.07 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.471 0.708 . . . . 20.0 111.478 177.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -53.7 -51.01 64.62 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.276 0.63 . . . . 20.0 111.969 171.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.97 -42.25 89.49 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.633 -0.667 . . . . 20.0 112.357 174.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -18.56 48.6 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.225 1.565 . . . . 20.0 115.225 177.0 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -95.89 20.1 10.46 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.302 2.241 . . . . 20.0 112.152 172.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.77 24.09 68.07 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 120.734 -1.229 . . . . 20.0 112.709 -177.187 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.51 -114.71 5.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.556 1.074 . . . . 20.0 111.279 -174.177 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -76.83 -9.67 18.23 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 121.935 1.757 . . . . 20.0 113.408 -178.128 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -32.8 70.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.499 1.296 . . . . 20.0 114.499 -175.361 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -79.12 11.03 3.01 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.998 1.11 . . . . 20.0 113.998 175.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.3 17.44 79.68 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.057 -1.027 . . . . 20.0 113.984 177.262 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -109.56 131.74 21.72 Favored Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 125.193 1.397 . . . . 20.0 110.238 -172.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -72.26 151.17 54.24 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.994 1.796 . . . . 20.0 111.833 -176.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.22 125.67 12.71 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.451 2.767 . . . . 20.0 111.638 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -81.36 111.28 2.34 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.288 2.658 . . . . 20.0 111.66 177.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.9 p . . . . . 0 C--O 1.248 1.025 0 C-N-CA 126.058 1.743 . . . . 20.0 110.681 177.12 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 119.104 -0.474 . . . . 20.0 112.056 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.07 -38.48 91.35 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.0 0.818 . . . . 20.0 112.229 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.48 -48.63 74.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.213 0.605 . . . . 20.0 110.813 173.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -67.27 -42.65 83.51 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.253 0.621 . . . . 20.0 112.117 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -47.3 -50.31 21.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.155 1.382 . . . . 20.0 111.984 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.83 -46.23 85.99 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.301 -0.857 . . . . 20.0 112.521 173.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -54.25 -44.17 71.56 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.389 0.995 . . . . 20.0 113.107 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.2 -18.72 65.53 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.536 0.939 . . . . 20.0 113.536 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.52 9.16 10.47 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.869 1.223 . . . . 20.0 115.17 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.16 -112.44 1.3 Allowed Glycine 0 CA--C 1.535 1.315 0 C-N-CA 127.258 2.361 . . . . 20.0 113.695 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.18 -30.4 60.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.246 2.631 . . . . 20.0 113.88 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -60.26 -38.58 83.94 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.007 1.323 . . . . 20.0 111.847 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.42 -18.3 45.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 126.472 1.909 . . . . 20.0 113.229 -174.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.57 -13.64 1.58 Allowed Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.938 1.733 . . . . 20.0 116.368 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -54.66 126.52 57.3 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.077 1.438 . . . . 20.0 111.229 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -52.59 129.71 33.39 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.279 2.653 . . . . 20.0 112.809 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -64.84 140.09 65.37 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.289 1.993 . . . . 20.0 111.941 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.538 0.704 0 C-N-CA 123.244 2.629 . . . . 20.0 110.75 176.183 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 112.463 0.542 . . . . 20.0 112.463 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -63.7 -37.27 86.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.256 0.622 . . . . 20.0 112.158 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.89 79.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.718 0.807 . . . . 20.0 111.032 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -69.75 -38.69 76.89 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.348 0.499 . . . . 20.0 112.348 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 t90 -51.17 -52.59 42.73 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.213 1.005 . . . . 20.0 111.451 174.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.4 -44.42 96.48 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.693 0.627 . . . . 20.0 112.693 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.45 57.79 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.517 1.303 . . . . 20.0 114.517 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.66 15.81 19.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.154 0.982 . . . . 20.0 112.941 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.12 20.98 37.01 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.494 1.045 . . . . 20.0 112.96 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.15 -114.36 3.64 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.197 1.855 . . . . 20.0 111.495 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -52.65 -28.78 38.65 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.092 3.195 . . . . 20.0 114.205 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -54.43 -29.28 48.84 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.079 1.351 . . . . 20.0 112.47 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -20.62 62.95 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.938 1.695 . . . . 20.0 113.55 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.17 17.12 65.49 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 124.703 1.145 . . . . 20.0 115.734 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 139.02 21.22 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 125.36 1.464 . . . . 20.0 111.167 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -52.55 129.38 31.84 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 123.732 2.955 . . . . 20.0 113.124 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -67.23 133.82 31.81 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.721 2.281 . . . . 20.0 111.912 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo . . . . . 0 CA--C 1.54 0.792 0 C-N-CA 123.797 2.998 . . . . 20.0 111.348 -178.228 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 112.576 0.584 . . . . 20.0 112.576 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -64.97 -38.83 92.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.74 1.616 . . . . 20.0 112.503 -176.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.75 -48.16 72.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.763 0.825 . . . . 20.0 111.013 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.32 -43.09 87.17 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.181 0.592 . . . . 20.0 111.68 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 49.4 t90 -53.28 -47.55 69.07 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.045 0.938 . . . . 20.0 112.041 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.99 -46.66 89.85 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 119.111 -0.471 . . . . 20.0 111.746 171.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.814 1.246 . . . . 20.0 113.899 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -67.69 -17.92 64.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.883 1.273 . . . . 20.0 113.632 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 21.37 4.25 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.345 1.45 . . . . 20.0 114.818 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.99 -129.22 38.05 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.548 1.174 . . . . 20.0 111.151 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.42 -10.33 22.13 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 121.952 1.768 . . . . 20.0 113.07 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -59.68 -34.64 73.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.868 1.267 . . . . 20.0 112.994 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.87 -4.51 38.32 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.015 1.726 . . . . 20.0 113.531 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.95 9.89 86.61 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 124.085 0.85 . . . . 20.0 114.795 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -94.55 133.3 27.11 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 125.379 1.472 . . . . 20.0 110.581 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.92 144.71 65.54 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.041 1.828 . . . . 20.0 111.55 176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.59 136.81 40.54 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.884 2.389 . . . . 20.0 111.302 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo . . . . . 0 CA--C 1.537 0.626 0 C-N-CA 122.923 2.415 . . . . 20.0 110.647 175.427 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 113.299 0.852 . . . . 20.0 113.299 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.58 -33.63 70.18 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.848 0.859 . . . . 20.0 112.853 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.34 -48.56 74.01 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.285 1.034 . . . . 20.0 111.803 171.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -67.46 -43.43 81.06 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.836 0.455 . . . . 20.0 110.838 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -47.9 -50.55 26.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.231 1.012 . . . . 20.0 112.029 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.61 -40.54 92.75 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.192 0.812 . . . . 20.0 113.192 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -32.39 66.96 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.446 1.276 . . . . 20.0 114.446 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -77.78 -12.8 60.01 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.502 0.927 . . . . 20.0 113.502 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.24 7.7 34.7 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.348 1.451 . . . . 20.0 114.382 -175.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.85 -113.71 5.31 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.143 -1.365 . . . . 20.0 112.528 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.51 -29.65 60.75 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.38 2.72 . . . . 20.0 114.817 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.9 p -56.39 -39.41 72.92 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.972 0.909 . . . . 20.0 112.887 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -82.8 -16.39 47.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.998 1.319 . . . . 20.0 113.052 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.01 -7.57 3.06 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.379 1.466 . . . . 20.0 116.238 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.48 125.08 51.25 Favored Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 119.195 1.497 . . . . 20.0 110.942 174.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.38 128.43 27.67 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.254 2.636 . . . . 20.0 112.961 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 136.01 42.69 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.383 2.056 . . . . 20.0 111.486 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 N--CA 1.457 -0.641 0 C-N-CA 122.789 2.326 . . . . 20.0 109.569 176.199 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.1 0 N-CA-C 117.379 2.363 . . . . 20.0 117.379 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.07 -38.12 75.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.277 1.431 . . . . 20.0 113.539 -175.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.96 81.64 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.544 -0.723 . . . . 20.0 111.479 174.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -65.8 -42.71 90.38 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.522 0.729 . . . . 20.0 111.241 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -49.67 -52.14 33.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.161 0.584 . . . . 20.0 111.381 174.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.98 -45.29 94.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.64 0.776 . . . . 20.0 112.796 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -52.56 -41.41 63.53 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.241 1.416 . . . . 20.0 113.184 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.78 8.31 3.82 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.734 1.614 . . . . 20.0 114.183 176.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.31 18.1 53.81 Favored Glycine 0 CA--C 1.532 1.129 0 O-C-N 120.631 -1.293 . . . . 20.0 113.532 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.95 -113.58 3.35 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.377 1.942 . . . . 20.0 112.472 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -53.32 -28.43 43.2 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.284 2.656 . . . . 20.0 113.61 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -55.33 -38.14 68.34 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.951 1.3 . . . . 20.0 112.152 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.7 p -72.44 -9.59 58.73 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 115.324 1.601 . . . . 20.0 115.324 174.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.59 17.43 62.34 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 119.997 1.272 . . . . 20.0 115.569 175.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -106.82 135.24 19.57 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 125.412 1.485 . . . . 20.0 111.316 -176.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.28 125.92 18.98 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.727 2.952 . . . . 20.0 113.281 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.14 135.21 39.49 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.492 2.128 . . . . 20.0 112.309 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 CA--C 1.537 0.625 0 C-N-CA 123.738 2.958 . . . . 20.0 111.254 -177.957 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 115.032 1.493 . . . . 20.0 115.032 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -60.38 -32.09 70.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.524 1.13 . . . . 20.0 113.266 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.5 98.76 Favored 'General case' 0 CA--C 1.537 0.442 0 O-C-N 121.891 -0.505 . . . . 20.0 110.683 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -41.9 75.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.248 1.019 . . . . 20.0 111.383 175.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.2 t90 -51.86 -51.14 58.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.633 0.773 . . . . 20.0 112.244 175.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.48 -36.48 82.63 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.943 0.72 . . . . 20.0 112.943 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -60.21 -33.32 72.09 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.683 1.193 . . . . 20.0 113.582 -177.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -83.24 3.68 30.15 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.983 1.313 . . . . 20.0 113.447 173.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.48 16.27 34.97 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 120.95 -1.094 . . . . 20.0 114.023 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.14 -107.02 0.84 Allowed Glycine 0 CA--C 1.533 1.194 0 C-N-CA 126.852 2.168 . . . . 20.0 113.277 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -55.66 -30.04 73.48 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.535 2.157 . . . . 20.0 113.508 172.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -57.35 -36.01 70.66 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.082 1.353 . . . . 20.0 112.473 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -15.85 61.78 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.931 1.692 . . . . 20.0 113.245 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.88 4.14 13.35 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.129 1.347 . . . . 20.0 115.744 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -79.88 136.03 55.0 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 125.672 1.589 . . . . 20.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_exo -44.71 121.21 3.22 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.193 3.262 . . . . 20.0 113.564 173.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.61 124.73 12.78 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.927 2.418 . . . . 20.0 110.589 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 CA--C 1.539 0.77 0 C-N-CA 121.887 1.725 . . . . 20.0 110.879 174.266 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.97 1.1 . . . . 20.0 113.97 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.29 -32.84 74.36 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.649 0.779 . . . . 20.0 112.623 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.2 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.676 0.791 . . . . 20.0 111.386 173.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -66.59 -45.57 78.81 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.562 -0.732 . . . . 20.0 110.946 175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -48.55 -49.29 36.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.531 0.732 . . . . 20.0 112.63 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.32 -46.54 85.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.006 0.522 . . . . 20.0 112.398 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -55.53 -32.21 62.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.627 1.171 . . . . 20.0 113.637 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -82.16 17.46 1.63 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.168 1.387 . . . . 20.0 114.252 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.61 27.9 37.37 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.331 1.443 . . . . 20.0 112.846 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -115.21 4.78 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.263 1.411 . . . . 20.0 111.697 -172.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.93 -8.61 17.9 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.239 1.959 . . . . 20.0 113.519 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.9 m -55.99 -36.45 67.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.899 1.279 . . . . 20.0 113.764 -171.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.07 -4.31 54.82 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.872 2.069 . . . . 20.0 113.514 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.97 -10.83 31.3 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.237 1.399 . . . . 20.0 115.421 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.79 117.65 22.64 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.196 1.799 . . . . 20.0 111.081 172.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.28 137.02 76.06 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 122.973 2.449 . . . . 20.0 112.969 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -66.36 134.31 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.861 2.374 . . . . 20.0 112.6 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 C--N 1.349 0.591 0 C-N-CA 123.325 2.683 . . . . 20.0 110.142 178.356 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 114.426 1.269 . . . . 20.0 114.426 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -63.93 -36.62 84.56 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.228 1.011 . . . . 20.0 112.273 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.62 82.46 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 122.969 0.508 . . . . 20.0 110.495 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -67.05 -38.82 86.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.452 0.538 . . . . 20.0 112.452 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.44 ' CD1' ' HD2' ' A' ' 16' ' ' ARG . 68.2 t90 -52.12 -51.55 57.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.886 0.875 . . . . 20.0 111.152 174.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.41 -45.32 94.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 119.094 -0.479 . . . . 20.0 112.159 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -55.39 -38.73 69.25 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.092 1.145 . . . . 20.0 114.092 -178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.0 5.7 4.03 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.356 1.243 . . . . 20.0 114.356 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.59 37.35 Favored Glycine 0 CA--C 1.531 1.084 0 O-C-N 120.616 -1.303 . . . . 20.0 112.913 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.99 -113.16 3.37 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.38 1.943 . . . . 20.0 112.523 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.78 -28.24 56.6 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.494 2.796 . . . . 20.0 114.131 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.5 m -52.47 -37.81 57.95 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 20.0 112.194 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -24.03 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.412 2.285 . . . . 20.0 114.578 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.61 1.66 Allowed Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.505 1.526 . . . . 20.0 116.884 -172.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD2' ' CD1' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -64.45 132.34 95.34 Favored Pre-proline 0 N--CA 1.476 0.838 0 CA-C-N 119.956 1.878 . . . . 20.0 111.281 174.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.5 126.81 18.8 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.503 2.802 . . . . 20.0 112.319 171.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -64.36 138.53 61.0 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.191 1.928 . . . . 20.0 111.501 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 N--CA 1.457 -0.634 0 C-N-CA 122.305 2.003 . . . . 20.0 110.764 175.775 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.58 0 N-CA-C 112.92 0.711 . . . . 20.0 112.92 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.34 -34.98 71.22 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.881 0.872 . . . . 20.0 112.821 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.73 -50.3 72.64 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 20.0 111.032 174.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -70.26 -33.84 72.08 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.545 0.738 . . . . 20.0 112.389 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -52.19 -55.19 22.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.767 0.827 . . . . 20.0 110.746 172.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.01 -47.15 87.78 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.829 -0.605 . . . . 20.0 112.331 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -39.53 70.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.549 0.74 . . . . 20.0 112.822 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -85.58 32.05 0.58 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.051 1.74 . . . . 20.0 112.379 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.73 27.29 54.4 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.396 0.998 . . . . 20.0 114.138 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.89 -116.92 8.92 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 118.087 0.943 . . . . 20.0 111.498 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.53 -14.95 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.062 1.842 . . . . 20.0 113.534 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -61.29 -23.64 65.84 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.284 1.216 . . . . 20.0 114.284 -174.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -3.23 33.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.733 1.213 . . . . 20.0 113.894 175.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.72 8.38 87.74 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.727 1.149 . . . . 20.0 114.87 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -97.65 127.35 37.89 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 125.664 1.586 . . . . 20.0 110.59 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -52.15 140.04 51.69 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.672 2.248 . . . . 20.0 112.377 172.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.52 130.4 28.12 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 122.634 2.223 . . . . 20.0 111.196 175.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo . . . . . 0 CA--C 1.539 0.728 0 C-N-CA 122.175 1.917 . . . . 20.0 110.799 174.575 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 113.134 0.791 . . . . 20.0 113.134 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.6 -34.91 73.35 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.91 0.884 . . . . 20.0 112.454 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.73 -31.31 72.21 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.8 0.84 . . . . 20.0 112.636 175.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -43.11 20.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.955 0.902 . . . . 20.0 110.571 171.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -48.0 -52.54 19.51 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.513 1.125 . . . . 20.0 112.316 176.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.4 mt -60.73 -39.05 87.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -59.17 -41.49 88.53 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.926 1.69 . . . . 20.0 111.954 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -76.01 28.66 0.11 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 126.683 1.993 . . . . 20.0 114.15 172.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.18 28.28 66.61 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 125.155 1.359 . . . . 20.0 113.698 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.76 -117.09 6.75 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.97 1.271 . . . . 20.0 111.56 -173.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -75.82 -10.81 20.01 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.04 1.827 . . . . 20.0 113.396 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -54.8 -39.58 68.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.308 1.043 . . . . 20.0 113.252 -173.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.7 m -75.81 -8.9 57.99 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.584 1.327 . . . . 20.0 114.584 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.01 -10.72 46.25 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 115.973 1.149 . . . . 20.0 115.973 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -58.7 122.84 64.31 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 118.93 1.365 . . . . 20.0 111.127 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -54.19 136.38 67.85 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.003 2.469 . . . . 20.0 112.931 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.64 130.26 24.45 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.783 2.322 . . . . 20.0 111.752 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 C-N-CA 122.727 2.284 . . . . 20.0 109.766 176.203 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.907 0 N-CA-C 114.194 1.183 . . . . 20.0 114.194 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.14 -37.63 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.5 1.12 . . . . 20.0 113.458 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.33 -45.44 91.34 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.635 -0.665 . . . . 20.0 111.372 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -66.92 -35.22 79.5 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.408 0.683 . . . . 20.0 111.836 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.7 t90 -58.26 -52.08 67.07 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.191 -0.943 . . . . 20.0 111.268 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -59.14 -44.62 92.06 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.371 0.668 . . . . 20.0 112.657 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -38.06 53.66 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.52 1.128 . . . . 20.0 113.596 176.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -83.63 26.49 0.68 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.956 1.702 . . . . 20.0 113.44 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.08 26.01 65.23 Favored Glycine 0 CA--C 1.531 1.066 0 O-C-N 121.09 -1.006 . . . . 20.0 112.986 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.14 -115.05 4.2 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.078 1.323 . . . . 20.0 111.65 -174.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -75.0 -9.72 20.9 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.209 1.939 . . . . 20.0 113.345 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 t -62.2 -34.01 75.65 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.711 1.004 . . . . 20.0 113.711 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.0 m -78.37 0.14 26.81 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.007 1.114 . . . . 20.0 114.007 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.25 14.23 82.53 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 119.432 1.015 . . . . 20.0 114.939 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -98.43 123.31 50.81 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 126.143 1.777 . . . . 20.0 110.239 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.74 138.63 59.51 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.917 2.411 . . . . 20.0 112.553 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.47 136.3 49.9 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.718 2.279 . . . . 20.0 111.928 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 CA--C 1.539 0.74 0 C-N-CA 123.404 2.736 . . . . 20.0 110.933 177.66 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 112.523 0.564 . . . . 20.0 112.523 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -64.27 -34.61 78.51 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.597 0.759 . . . . 20.0 111.95 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.14 -46.18 72.18 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.135 0.42 . . . . 20.0 112.135 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -67.08 -42.37 84.78 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.511 0.596 . . . . 20.0 111.958 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -53.91 -47.69 70.92 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.79 0.436 . . . . 20.0 111.408 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.07 -41.78 97.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.929 0.714 . . . . 20.0 112.929 171.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -54.77 -42.62 71.93 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.514 1.126 . . . . 20.0 112.904 177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.27 -6.97 38.68 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.288 1.435 . . . . 20.0 113.822 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.7 2.89 37.25 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.499 1.523 . . . . 20.0 115.461 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 45.68 -109.39 0.32 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.566 2.031 . . . . 20.0 114.066 -178.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -54.88 -34.04 84.21 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.799 2.333 . . . . 20.0 113.681 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 m -66.6 -29.78 69.91 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.514 0.725 . . . . 20.0 112.819 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.27 -18.32 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.326 1.05 . . . . 20.0 112.704 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.93 5.69 53.37 Favored Glycine 0 CA--C 1.539 1.553 0 C-N-CA 124.755 1.169 . . . . 20.0 115.461 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -78.82 132.98 62.79 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.183 1.393 . . . . 20.0 110.548 178.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -41.94 121.65 1.85 Allowed 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.452 3.435 . . . . 20.0 114.183 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -67.32 128.58 18.62 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.321 2.681 . . . . 20.0 112.057 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo . . . . . 0 CA--C 1.54 0.799 0 C-N-CA 123.033 2.488 . . . . 20.0 111.024 176.359 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.251 0 N-CA-C 118.191 2.663 . . . . 20.0 118.191 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.71 -33.95 73.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.821 2.048 . . . . 20.0 114.117 -170.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.9 87.44 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.773 -0.579 . . . . 20.0 111.103 174.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.65 -45.13 88.06 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.554 0.741 . . . . 20.0 111.137 175.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.2 t90 -50.15 -48.8 53.65 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.807 0.843 . . . . 20.0 111.67 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.35 -54.44 43.71 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 118.487 -0.768 . . . . 20.0 112.099 171.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -52.49 -37.56 57.52 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.081 1.141 . . . . 20.0 114.081 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -71.66 -11.88 61.06 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.994 1.109 . . . . 20.0 113.994 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.98 22.31 3.93 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.683 1.135 . . . . 20.0 114.076 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.79 -129.66 45.2 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 118.227 1.013 . . . . 20.0 111.095 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.76 -15.58 37.15 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.469 2.113 . . . . 20.0 112.696 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 t -62.52 -15.39 50.23 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.488 0.921 . . . . 20.0 113.488 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -77.69 -10.42 59.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.482 1.513 . . . . 20.0 113.55 177.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.12 12.4 84.66 Favored Glycine 0 CA--C 1.538 1.474 0 CA-C-N 119.104 0.866 . . . . 20.0 114.922 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.17 126.48 29.59 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.869 1.668 . . . . 20.0 110.516 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -52.13 140.74 50.12 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.387 2.725 . . . . 20.0 113.282 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.81 126.75 17.22 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.437 2.758 . . . . 20.0 112.171 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo . . . . . 0 CA--C 1.548 1.179 0 C-N-CA 123.294 2.662 . . . . 20.0 111.889 177.539 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 113.334 0.864 . . . . 20.0 113.334 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -65.17 -38.82 91.77 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.627 0.771 . . . . 20.0 112.586 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.49 -44.54 85.03 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.802 0.728 . . . . 20.0 112.092 172.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.5 -43.0 77.78 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.967 -0.458 . . . . 20.0 111.67 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -51.88 -48.05 64.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.354 0.661 . . . . 20.0 111.348 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.02 -47.07 87.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 117.948 -1.025 . . . . 20.0 112.806 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -52.97 -40.8 64.0 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.704 1.138 . . . . 20.0 112.816 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -73.16 19.34 0.09 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 125.06 1.344 . . . . 20.0 113.616 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 26.13 47.96 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 126.562 2.03 . . . . 20.0 113.091 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.64 -115.97 4.36 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.77 1.176 . . . . 20.0 111.241 -170.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.75 -9.21 19.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.039 1.826 . . . . 20.0 113.504 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -59.8 -27.82 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.798 1.407 . . . . 20.0 114.798 -173.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -6.09 58.02 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.174 1.39 . . . . 20.0 113.165 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.01 -12.51 42.83 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.755 1.169 . . . . 20.0 115.511 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -58.98 119.42 37.79 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 125.589 1.556 . . . . 20.0 111.037 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.09 135.08 58.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.123 2.549 . . . . 20.0 112.783 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -63.51 139.26 69.46 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.545 2.163 . . . . 20.0 112.635 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo . . . . . 0 CA--C 1.538 0.713 0 C-N-CA 123.379 2.719 . . . . 20.0 111.056 176.12 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.789 0 N-CA-C 115.734 1.754 . . . . 20.0 115.734 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.66 -32.47 69.13 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.033 1.333 . . . . 20.0 113.359 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.13 -45.38 94.91 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.269 0.628 . . . . 20.0 111.06 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -68.61 -42.79 77.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.186 -0.435 . . . . 20.0 111.364 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -51.04 -49.84 59.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.329 0.652 . . . . 20.0 111.628 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.18 -47.74 84.68 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.97 0.73 . . . . 20.0 112.97 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.14 -38.67 65.73 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.152 0.887 . . . . 20.0 112.883 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -78.46 18.86 0.51 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.749 1.62 . . . . 20.0 113.549 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.12 23.61 37.33 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.589 1.566 . . . . 20.0 113.626 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.24 -116.93 7.49 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.861 1.22 . . . . 20.0 110.978 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.06 -9.89 20.88 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.106 1.871 . . . . 20.0 113.541 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 t -56.62 -36.64 69.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.536 1.062 . . . . 20.0 113.427 -175.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -8.01 52.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.384 1.473 . . . . 20.0 113.97 176.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.98 2.94 59.07 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.663 1.12 . . . . 20.0 115.248 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -74.11 133.82 78.08 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.029 1.332 . . . . 20.0 110.939 179.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -44.49 121.2 3.09 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.334 3.356 . . . . 20.0 113.634 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.53 118.38 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.229 2.619 . . . . 20.0 110.735 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 CA--C 1.537 0.668 0 C-N-CA 121.612 1.541 . . . . 20.0 110.511 173.655 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.404 0.891 . . . . 20.0 113.404 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -61.17 -39.89 91.84 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.709 1.204 . . . . 20.0 112.599 -172.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.83 78.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.885 0.874 . . . . 20.0 111.637 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -71.04 -41.83 70.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.161 0.584 . . . . 20.0 111.27 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.8 t90 -51.05 -48.59 61.51 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.836 0.854 . . . . 20.0 111.603 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.75 -43.21 94.39 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 118.723 -0.656 . . . . 20.0 112.65 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -57.18 -35.69 69.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.22 0.918 . . . . 20.0 113.366 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -73.42 13.31 0.47 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.304 1.224 . . . . 20.0 114.304 171.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 21.3 59.95 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.16 -1.587 . . . . 20.0 112.81 -175.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.3 -120.54 16.22 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.246 1.403 . . . . 20.0 111.805 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.7 -10.22 20.04 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.391 2.061 . . . . 20.0 113.208 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 t -72.94 -19.86 61.17 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.93 1.085 . . . . 20.0 113.93 -171.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.2 m -92.85 14.94 15.91 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.653 1.181 . . . . 20.0 113.969 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.48 14.36 74.67 Favored Glycine 0 CA--C 1.536 1.38 0 O-C-N 121.17 -0.956 . . . . 20.0 114.422 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -104.02 126.81 30.72 Favored Pre-proline 0 C--N 1.35 0.614 0 C-N-CA 125.099 1.36 . . . . 20.0 110.078 -171.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.0 144.5 47.59 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.241 1.961 . . . . 20.0 111.473 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.74 136.4 35.71 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.693 2.262 . . . . 20.0 111.779 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo . . . . . 0 CA--C 1.541 0.839 0 C-N-CA 123.767 2.978 . . . . 20.0 110.948 178.061 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.811 0 N-CA-C 113.218 0.822 . . . . 20.0 113.218 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -56.55 -42.1 77.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.33 1.452 . . . . 20.0 113.724 -174.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -48.82 74.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.054 0.942 . . . . 20.0 111.731 174.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.39 -43.47 81.27 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.661 0.384 . . . . 20.0 111.419 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -50.72 -50.48 55.17 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.958 0.903 . . . . 20.0 111.561 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.51 -44.46 97.04 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.638 0.607 . . . . 20.0 112.638 173.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -57.52 -34.92 69.6 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 20.0 113.572 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.82 -6.13 47.32 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 172.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.92 11.05 29.09 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.79 1.186 . . . . 20.0 114.224 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.68 -109.5 0.83 Allowed Glycine 0 CA--C 1.533 1.199 0 C-N-CA 126.523 2.011 . . . . 20.0 113.168 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -54.91 -31.66 74.44 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.713 2.275 . . . . 20.0 113.772 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -56.8 -38.07 72.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.163 0.985 . . . . 20.0 112.271 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -18.21 63.02 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.282 1.433 . . . . 20.0 113.635 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.99 3.73 12.09 Favored Glycine 0 CA--C 1.541 1.713 0 C-N-CA 124.945 1.259 . . . . 20.0 115.905 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 136.53 71.3 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.553 1.541 . . . . 20.0 110.003 177.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -45.36 120.91 3.44 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.177 3.251 . . . . 20.0 113.561 168.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.76 133.21 25.01 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.86 2.373 . . . . 20.0 111.943 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo . . . . . 0 CA--C 1.54 0.784 0 C-N-CA 123.351 2.7 . . . . 20.0 109.894 173.079 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 113.195 0.813 . . . . 20.0 113.195 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.71 -34.69 67.29 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.356 -0.84 . . . . 20.0 112.135 -170.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.57 70.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.43 0.692 . . . . 20.0 110.852 172.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -65.83 -41.26 92.01 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.825 0.85 . . . . 20.0 112.034 177.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -49.75 -51.47 38.78 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.399 0.545 . . . . 20.0 111.309 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.07 -50.37 72.23 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.853 -0.594 . . . . 20.0 112.063 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.8 tptp -56.34 -37.09 69.53 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.348 1.24 . . . . 20.0 114.348 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.32 -7.14 47.92 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.817 1.247 . . . . 20.0 114.357 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.49 23.02 4.57 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.419 1.009 . . . . 20.0 113.917 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.09 -127.74 43.95 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 118.197 0.999 . . . . 20.0 111.61 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.61 -14.69 36.93 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.077 2.518 . . . . 20.0 113.399 -174.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.6 m -70.44 -1.86 12.07 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.933 1.086 . . . . 20.0 113.933 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 m -91.63 6.04 47.33 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.998 1.719 . . . . 20.0 113.666 -170.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.9 12.99 79.07 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.552 1.072 . . . . 20.0 114.882 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -127.35 122.28 22.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.572 1.949 . . . . 20.0 110.679 -175.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.68 150.78 21.03 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.241 2.627 . . . . 20.0 113.784 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.22 115.06 2.76 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.083 3.189 . . . . 20.0 112.242 176.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo . . . . . 0 CA--C 1.54 0.82 0 C-N-CA 123.363 2.709 . . . . 20.0 110.839 179.73 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.826 0 N-CA-C 114.389 1.255 . . . . 20.0 114.389 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -57.91 -43.04 85.94 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.305 1.442 . . . . 20.0 113.62 -171.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.08 -45.03 79.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.834 0.853 . . . . 20.0 111.873 173.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -42.99 69.72 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.841 0.856 . . . . 20.0 111.661 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -51.07 -49.82 59.9 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.209 1.404 . . . . 20.0 111.645 174.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.93 -44.78 96.07 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.026 0.53 . . . . 20.0 112.138 173.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -56.08 -41.25 74.86 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.603 1.161 . . . . 20.0 112.943 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -69.7 -8.32 46.8 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.746 1.218 . . . . 20.0 113.949 174.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.04 8.21 39.54 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.897 1.237 . . . . 20.0 115.303 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 48.33 -110.0 0.6 Allowed Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.539 2.019 . . . . 20.0 113.814 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.74 -28.53 67.07 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.796 2.33 . . . . 20.0 114.029 176.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 t -69.77 -29.96 67.41 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.664 0.786 . . . . 20.0 112.942 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.73 -21.25 38.03 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.535 1.134 . . . . 20.0 112.622 -176.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.03 -14.43 20.65 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.856 1.693 . . . . 20.0 115.665 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 129.48 92.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 118.875 1.337 . . . . 20.0 111.029 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.54 135.17 60.7 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.08 2.52 . . . . 20.0 112.669 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.37 134.91 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.672 2.248 . . . . 20.0 112.291 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo . . . . . 0 CA--C 1.538 0.718 0 C-N-CA 123.603 2.869 . . . . 20.0 110.878 177.616 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.105 0 N-CA-C 116.27 1.952 . . . . 20.0 116.27 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -63.04 -36.79 84.75 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 113.823 1.045 . . . . 20.0 113.823 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.7 88.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.827 -0.546 . . . . 20.0 111.109 174.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -68.07 -42.39 80.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.003 0.521 . . . . 20.0 111.779 175.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -49.92 -47.79 52.1 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.237 0.615 . . . . 20.0 112.068 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.2 -44.89 94.08 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.318 0.858 . . . . 20.0 113.318 174.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -53.49 -39.45 64.56 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.372 1.069 . . . . 20.0 113.023 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.94 16.24 0.32 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 124.658 1.183 . . . . 20.0 114.037 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.63 27.98 40.65 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 120.027 -1.67 . . . . 20.0 112.662 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.4 -118.13 11.74 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.531 1.539 . . . . 20.0 111.985 -176.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -75.02 -7.07 18.82 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.392 2.061 . . . . 20.0 113.178 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -56.65 -34.84 67.73 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.701 1.2 . . . . 20.0 113.367 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.11 -8.35 37.47 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.612 1.565 . . . . 20.0 114.736 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.86 3.33 90.52 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-N 119.219 0.918 . . . . 20.0 114.437 -173.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -89.5 134.29 32.88 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 124.734 1.214 . . . . 20.0 110.477 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -72.3 152.81 55.95 Favored 'Trans proline' 0 CA--C 1.547 1.154 0 C-N-CA 122.097 1.865 . . . . 20.0 112.314 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.62 124.41 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.97 3.113 . . . . 20.0 111.99 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.542 0.885 0 C-N-CA 123.373 2.715 . . . . 20.0 112.085 -178.297 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 113.297 0.851 . . . . 20.0 113.297 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.33 -39.64 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.403 1.081 . . . . 20.0 111.771 -175.003 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.58 85.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.242 0.617 . . . . 20.0 111.836 173.775 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -44.83 86.47 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.291 0.636 . . . . 20.0 111.182 176.019 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -52.19 -46.91 65.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.024 0.529 . . . . 20.0 112.123 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -41.13 98.73 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.957 0.725 . . . . 20.0 112.957 174.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -39.66 66.97 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.133 0.973 . . . . 20.0 112.878 177.697 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -82.96 25.75 0.66 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.547 1.539 . . . . 20.0 113.988 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.71 27.31 59.12 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.938 1.256 . . . . 20.0 113.031 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.92 -115.39 6.41 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.22 1.39 . . . . 20.0 111.465 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -77.24 -5.96 16.12 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 122.292 1.994 . . . . 20.0 113.49 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.3 m -58.22 -34.06 70.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.63 1.172 . . . . 20.0 113.625 -173.446 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -5.03 44.74 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.403 1.881 . . . . 20.0 113.642 176.603 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.66 8.14 86.07 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.495 1.043 . . . . 20.0 114.913 -177.676 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -83.41 131.99 51.15 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.69 1.596 . . . . 20.0 110.471 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.09 140.18 48.83 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.005 1.804 . . . . 20.0 111.107 174.065 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.62 143.23 61.54 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.832 2.355 . . . . 20.0 111.942 178.558 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo . . . . . 0 CA--C 1.539 0.768 0 C-N-CA 123.344 2.696 . . . . 20.0 110.87 177.047 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.686 0 N-CA-C 112.826 0.676 . . . . 20.0 112.826 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -59.03 -35.36 73.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.608 0.763 . . . . 20.0 112.472 177.69 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.63 88.6 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.325 0.65 . . . . 20.0 111.734 176.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.85 -42.3 63.88 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.975 0.51 . . . . 20.0 111.195 175.372 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.7 t90 -54.5 -44.14 72.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.798 . . . . 20.0 112.103 177.942 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -62.02 -39.22 91.56 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.596 -0.69 . . . . 20.0 112.652 174.822 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -30.44 63.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.083 1.353 . . . . 20.0 112.323 176.677 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -85.73 18.57 2.82 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.688 1.195 . . . . 20.0 113.018 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.82 27.38 67.05 Favored Glycine 0 C--N 1.348 1.204 0 C-N-CA 125.796 1.665 . . . . 20.0 113.003 -173.86 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.81 -118.44 14.67 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.185 0.898 . . . . 20.0 111.462 -176.181 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -81.3 6.08 5.83 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.05 2.5 . . . . 20.0 113.677 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.3 p -68.87 -33.96 74.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.054 1.297 . . . . 20.0 113.468 -177.318 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -10.29 59.61 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.148 0.979 . . . . 20.0 113.031 177.285 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.09 16.26 79.04 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 123.771 0.7 . . . . 20.0 114.025 -176.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.16 133.58 31.5 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 125.338 1.455 . . . . 20.0 110.927 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.66 135.18 37.78 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.095 1.863 . . . . 20.0 111.392 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.0 136.44 65.51 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.61 2.874 . . . . 20.0 112.261 177.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo . . . . . 0 CA--C 1.539 0.735 0 C-N-CA 123.778 2.985 . . . . 20.0 111.39 -179.248 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 113.555 0.946 . . . . 20.0 113.555 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.83 -37.5 87.6 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.466 1.106 . . . . 20.0 113.18 -172.385 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.33 -47.04 82.58 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.352 0.661 . . . . 20.0 111.294 175.338 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -67.02 -42.31 85.14 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.648 0.779 . . . . 20.0 111.588 175.777 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -50.29 -50.84 49.25 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.864 0.866 . . . . 20.0 111.597 175.399 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.52 -45.19 94.72 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 119.154 -0.45 . . . . 20.0 112.163 173.061 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -54.09 -39.71 66.6 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.754 1.222 . . . . 20.0 113.095 178.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -75.39 12.64 0.92 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.547 1.539 . . . . 20.0 113.674 177.845 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.27 27.96 31.86 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 120.423 -1.423 . . . . 20.0 112.762 -176.511 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.19 -117.25 10.46 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.567 1.556 . . . . 20.0 111.882 -177.207 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.98 -7.4 19.15 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.404 2.069 . . . . 20.0 113.364 -179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.2 m -54.96 -34.24 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.772 1.229 . . . . 20.0 113.505 -174.64 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.02 -9.42 52.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.68 1.992 . . . . 20.0 114.474 176.248 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.14 8.96 87.01 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.086 0.857 . . . . 20.0 114.466 -174.127 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -92.35 131.23 35.04 Favored Pre-proline 0 CA--C 1.539 0.558 0 C-N-CA 125.017 1.327 . . . . 20.0 110.628 178.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -65.34 149.74 87.96 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 121.938 1.758 . . . . 20.0 112.176 174.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.45 128.34 16.17 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.827 3.018 . . . . 20.0 112.068 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo . . . . . 0 CA--C 1.54 0.815 0 C-N-CA 123.523 2.815 . . . . 20.0 111.185 -178.653 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.594 1.331 . . . . 20.0 114.594 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.37 -37.62 85.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.694 1.198 . . . . 20.0 113.438 -174.271 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.24 -44.75 88.41 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.314 0.646 . . . . 20.0 111.249 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -66.75 -41.31 88.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.006 0.522 . . . . 20.0 111.56 175.665 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 t90 -53.52 -49.45 67.56 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.215 0.461 . . . . 20.0 111.751 174.035 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.53 -40.95 98.43 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 118.585 -0.721 . . . . 20.0 112.923 174.421 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -53.55 -36.09 61.45 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.039 1.126 . . . . 20.0 114.039 176.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -79.77 10.83 3.66 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.728 1.211 . . . . 20.0 113.642 175.792 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.45 25.75 32.3 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 120.51 -1.369 . . . . 20.0 112.698 -176.319 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.39 -114.93 6.0 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.251 1.405 . . . . 20.0 111.772 -177.949 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.17 -6.51 15.76 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.261 1.974 . . . . 20.0 113.472 -179.553 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -56.59 -40.29 75.02 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.58 1.082 . . . . 20.0 113.478 -175.352 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -7.68 21.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 127.409 2.284 . . . . 20.0 114.909 174.364 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.26 10.94 84.41 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.714 1.143 . . . . 20.0 114.481 -175.75 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -90.44 134.34 31.25 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 125.322 1.449 . . . . 20.0 110.628 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.71 143.77 57.33 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.037 1.825 . . . . 20.0 111.582 178.143 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.04 141.72 49.0 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.05 2.5 . . . . 20.0 111.482 177.264 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 CA--C 1.538 0.686 0 C-N-CA 122.895 2.397 . . . . 20.0 111.003 177.166 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.658 1.355 . . . . 20.0 114.658 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.06 -37.63 85.71 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.001 1.32 . . . . 20.0 113.299 -172.102 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.18 88.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.352 0.661 . . . . 20.0 111.48 174.043 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -69.27 -42.32 75.69 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.457 0.703 . . . . 20.0 111.512 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -49.82 -51.64 38.29 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.868 0.867 . . . . 20.0 111.851 172.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.79 -46.02 90.5 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 118.822 -0.609 . . . . 20.0 112.545 173.875 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -52.68 -43.28 65.47 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.844 0.858 . . . . 20.0 113.075 175.899 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -71.25 17.03 0.08 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.298 1.439 . . . . 20.0 114.01 175.237 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.68 21.28 56.47 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 120.007 -1.683 . . . . 20.0 113.163 -178.689 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.99 -120.53 15.34 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.364 1.459 . . . . 20.0 111.706 -177.626 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.44 -9.13 21.36 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.351 2.034 . . . . 20.0 113.388 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 t -76.07 -12.69 60.17 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.442 1.275 . . . . 20.0 114.442 -171.987 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 m -95.3 15.74 18.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.41 1.084 . . . . 20.0 113.885 179.696 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.26 16.41 73.25 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.261 -0.9 . . . . 20.0 114.088 177.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -112.91 128.05 26.09 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 125.485 1.514 . . . . 20.0 110.429 -170.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.35 146.68 51.17 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.156 1.904 . . . . 20.0 111.696 -176.175 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.84 130.96 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.22 2.613 . . . . 20.0 112.091 178.83 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.536 0.624 0 C-N-CA 123.436 2.757 . . . . 20.0 110.379 178.011 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 114.142 1.164 . . . . 20.0 114.142 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.35 -35.37 71.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.99 0.916 . . . . 20.0 113.324 -176.838 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.26 -42.11 76.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.386 1.074 . . . . 20.0 112.223 173.26 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -73.54 -40.78 63.73 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.128 0.571 . . . . 20.0 111.126 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -53.93 -47.69 70.97 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.466 0.706 . . . . 20.0 112.242 175.908 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.73 -39.69 81.6 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.853 0.686 . . . . 20.0 112.853 174.585 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -34.08 69.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.038 1.335 . . . . 20.0 112.742 177.954 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -84.09 24.57 0.92 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.292 1.837 . . . . 20.0 113.241 174.237 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.06 24.63 76.22 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 120.931 -1.106 . . . . 20.0 112.848 -179.092 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.84 -112.7 2.98 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.458 1.504 . . . . 20.0 111.495 -174.543 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.85 -10.48 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.075 1.85 . . . . 20.0 113.255 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.1 t -58.09 -42.67 86.1 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.37 0.986 . . . . 20.0 113.372 -174.473 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.9 m -70.73 3.0 3.5 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.887 1.439 . . . . 20.0 114.887 174.539 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.0 9.61 85.28 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.188 1.358 . . . . 20.0 114.547 178.274 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -89.12 129.33 48.38 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.538 1.935 . . . . 20.0 109.974 -179.203 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.21 146.65 76.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.857 1.705 . . . . 20.0 111.201 176.302 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.46 134.03 31.97 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.922 2.414 . . . . 20.0 111.746 179.362 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 CA--C 1.539 0.755 0 C-N-CA 123.324 2.683 . . . . 20.0 110.871 176.632 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.94 0 N-CA-C 113.345 0.869 . . . . 20.0 113.345 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.01 -38.79 87.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.602 1.161 . . . . 20.0 113.075 -173.449 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.37 -33.01 73.89 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.793 0.837 . . . . 20.0 112.718 176.303 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -76.76 -43.69 35.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.633 0.773 . . . . 20.0 110.673 172.573 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -50.02 -50.44 47.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.379 0.672 . . . . 20.0 111.746 175.666 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.54 -39.04 89.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.092 0.775 . . . . 20.0 113.092 173.714 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.09 -41.46 78.93 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.608 1.163 . . . . 20.0 112.338 177.207 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -79.04 18.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.595 1.558 . . . . 20.0 114.151 176.226 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.76 22.11 54.11 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.825 1.202 . . . . 20.0 113.489 178.671 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.82 -116.25 8.73 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.525 1.059 . . . . 20.0 110.751 -175.359 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.69 -10.77 17.06 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.059 1.839 . . . . 20.0 113.646 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.4 m -58.74 -30.04 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.021 1.282 . . . . 20.0 114.196 -175.123 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.19 -3.46 39.69 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.302 1.441 . . . . 20.0 113.562 175.502 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.43 5.88 83.02 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 119.548 1.067 . . . . 20.0 114.489 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -83.09 130.82 55.76 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 126.759 2.023 . . . . 20.0 110.165 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.06 143.83 67.12 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.053 1.835 . . . . 20.0 111.397 174.692 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.95 134.76 33.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.023 2.482 . . . . 20.0 111.568 178.542 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo . . . . . 0 CA--C 1.536 0.615 0 C-N-CA 123.111 2.541 . . . . 20.0 110.826 177.339 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.23 0 N-CA-C 116.949 2.203 . . . . 20.0 116.949 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -61.21 -41.4 96.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.789 1.635 . . . . 20.0 113.674 -171.33 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.72 80.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.528 0.731 . . . . 20.0 111.739 174.607 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -68.67 -40.63 80.07 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.471 0.708 . . . . 20.0 111.478 177.915 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -53.7 -51.01 64.62 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.276 0.63 . . . . 20.0 111.969 171.947 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.97 -42.25 89.49 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.633 -0.667 . . . . 20.0 112.357 174.599 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -18.56 48.6 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.225 1.565 . . . . 20.0 115.225 177.0 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -95.89 20.1 10.46 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.302 2.241 . . . . 20.0 112.152 172.788 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.77 24.09 68.07 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 120.734 -1.229 . . . . 20.0 112.709 -177.187 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.51 -114.71 5.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.556 1.074 . . . . 20.0 111.279 -174.177 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -76.83 -9.67 18.23 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 121.935 1.757 . . . . 20.0 113.408 -178.128 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -32.8 70.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.499 1.296 . . . . 20.0 114.499 -175.361 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -79.12 11.03 3.01 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.998 1.11 . . . . 20.0 113.998 175.715 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.3 17.44 79.68 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.057 -1.027 . . . . 20.0 113.984 177.262 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -109.56 131.74 21.72 Favored Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 125.193 1.397 . . . . 20.0 110.238 -172.952 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -72.26 151.17 54.24 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.994 1.796 . . . . 20.0 111.833 -176.725 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.22 125.67 12.71 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.451 2.767 . . . . 20.0 111.638 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo . . . . . 0 CA--C 1.541 0.841 0 C-N-CA 123.288 2.658 . . . . 20.0 111.66 177.715 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.3 -40.71 94.17 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.553 0.741 . . . . 20.0 112.056 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.07 -38.48 91.35 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.0 0.818 . . . . 20.0 112.229 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.48 -48.63 74.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.213 0.605 . . . . 20.0 110.813 173.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -67.27 -42.65 83.51 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.253 0.621 . . . . 20.0 112.117 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -47.3 -50.31 21.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.155 1.382 . . . . 20.0 111.984 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.83 -46.23 85.99 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.301 -0.857 . . . . 20.0 112.521 173.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -54.25 -44.17 71.56 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.389 0.995 . . . . 20.0 113.107 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.2 -18.72 65.53 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.536 0.939 . . . . 20.0 113.536 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.52 9.16 10.47 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.869 1.223 . . . . 20.0 115.17 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.16 -112.44 1.3 Allowed Glycine 0 CA--C 1.535 1.315 0 C-N-CA 127.258 2.361 . . . . 20.0 113.695 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.18 -30.4 60.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.246 2.631 . . . . 20.0 113.88 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -60.26 -38.58 83.94 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.007 1.323 . . . . 20.0 111.847 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.42 -18.3 45.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 126.472 1.909 . . . . 20.0 113.229 -174.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.57 -13.64 1.58 Allowed Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.938 1.733 . . . . 20.0 116.368 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -54.66 126.52 57.3 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.077 1.438 . . . . 20.0 111.229 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -52.59 129.71 33.39 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.279 2.653 . . . . 20.0 112.809 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -64.84 140.09 65.37 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.289 1.993 . . . . 20.0 111.941 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.17 114.91 3.87 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.244 2.629 . . . . 20.0 110.75 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 39.9 m . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.11 -1.424 . . . . 20.0 111.823 169.141 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 119.098 -0.477 . . . . 20.0 111.162 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.58 -32.0 71.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.463 0.542 . . . . 20.0 112.463 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -63.7 -37.27 86.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.256 0.622 . . . . 20.0 112.158 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.89 79.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.718 0.807 . . . . 20.0 111.032 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -69.75 -38.69 76.89 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.348 0.499 . . . . 20.0 112.348 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 t90 -51.17 -52.59 42.73 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.213 1.005 . . . . 20.0 111.451 174.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.4 -44.42 96.48 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.693 0.627 . . . . 20.0 112.693 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.45 57.79 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.517 1.303 . . . . 20.0 114.517 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.66 15.81 19.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.154 0.982 . . . . 20.0 112.941 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.12 20.98 37.01 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.494 1.045 . . . . 20.0 112.96 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.15 -114.36 3.64 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.197 1.855 . . . . 20.0 111.495 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -52.65 -28.78 38.65 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.092 3.195 . . . . 20.0 114.205 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -54.43 -29.28 48.84 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.079 1.351 . . . . 20.0 112.47 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -20.62 62.95 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.938 1.695 . . . . 20.0 113.55 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.17 17.12 65.49 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 124.703 1.145 . . . . 20.0 115.734 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 139.02 21.22 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 125.36 1.464 . . . . 20.0 111.167 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -52.55 129.38 31.84 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 123.732 2.955 . . . . 20.0 113.124 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -67.23 133.82 31.81 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.721 2.281 . . . . 20.0 111.912 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -77.4 81.98 2.5 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.797 2.998 . . . . 20.0 111.348 -178.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.249 1.052 0 CA-C-O 116.726 -1.606 . . . . 20.0 111.989 170.449 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 112.921 0.712 . . . . 20.0 112.921 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.12 14.72 23.77 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.284 1.433 . . . . 20.0 112.576 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -64.97 -38.83 92.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.74 1.616 . . . . 20.0 112.503 -176.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.75 -48.16 72.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.763 0.825 . . . . 20.0 111.013 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.32 -43.09 87.17 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.181 0.592 . . . . 20.0 111.68 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 49.4 t90 -53.28 -47.55 69.07 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.045 0.938 . . . . 20.0 112.041 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.99 -46.66 89.85 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 119.111 -0.471 . . . . 20.0 111.746 171.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.814 1.246 . . . . 20.0 113.899 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -67.69 -17.92 64.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.883 1.273 . . . . 20.0 113.632 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 21.37 4.25 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.345 1.45 . . . . 20.0 114.818 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.99 -129.22 38.05 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.548 1.174 . . . . 20.0 111.151 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.42 -10.33 22.13 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 121.952 1.768 . . . . 20.0 113.07 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -59.68 -34.64 73.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.868 1.267 . . . . 20.0 112.994 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.87 -4.51 38.32 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.015 1.726 . . . . 20.0 113.531 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.95 9.89 86.61 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 124.085 0.85 . . . . 20.0 114.795 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -94.55 133.3 27.11 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 125.379 1.472 . . . . 20.0 110.581 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.92 144.71 65.54 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.041 1.828 . . . . 20.0 111.55 176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.59 136.81 40.54 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.884 2.389 . . . . 20.0 111.302 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.32 136.31 15.81 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.923 2.415 . . . . 20.0 110.647 175.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.253 1.256 0 C-N-CA 128.119 2.568 . . . . 20.0 108.814 176.215 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 16.3 t0 . . . . . 0 N--CA 1.474 0.764 0 CA-C-O 120.702 0.286 . . . . 20.0 110.61 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.64 -36.74 0.14 Allowed 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.299 0.852 . . . . 20.0 113.299 -177.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.58 -33.63 70.18 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.848 0.859 . . . . 20.0 112.853 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.34 -48.56 74.01 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.285 1.034 . . . . 20.0 111.803 171.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -67.46 -43.43 81.06 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.836 0.455 . . . . 20.0 110.838 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -47.9 -50.55 26.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.231 1.012 . . . . 20.0 112.029 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.61 -40.54 92.75 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.192 0.812 . . . . 20.0 113.192 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -32.39 66.96 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.446 1.276 . . . . 20.0 114.446 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -77.78 -12.8 60.01 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.502 0.927 . . . . 20.0 113.502 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.24 7.7 34.7 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.348 1.451 . . . . 20.0 114.382 -175.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.85 -113.71 5.31 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.143 -1.365 . . . . 20.0 112.528 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.51 -29.65 60.75 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.38 2.72 . . . . 20.0 114.817 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.9 p -56.39 -39.41 72.92 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.972 0.909 . . . . 20.0 112.887 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -82.8 -16.39 47.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.998 1.319 . . . . 20.0 113.052 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.01 -7.57 3.06 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.379 1.466 . . . . 20.0 116.238 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.48 125.08 51.25 Favored Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 119.195 1.497 . . . . 20.0 110.942 174.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.38 128.43 27.67 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.254 2.636 . . . . 20.0 112.961 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 136.01 42.69 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.383 2.056 . . . . 20.0 111.486 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.46 124.58 9.98 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.789 2.326 . . . . 20.0 109.569 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.1 m . . . . . 0 C--O 1.251 1.153 0 C-N-CA 126.125 1.77 . . . . 20.0 109.712 176.835 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 118.464 -0.779 . . . . 20.0 111.468 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 59.0 2.01 0.23 Allowed 'General case' 0 CA--C 1.554 1.1 0 N-CA-C 117.379 2.363 . . . . 20.0 117.379 178.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.07 -38.12 75.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.277 1.431 . . . . 20.0 113.539 -175.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.96 81.64 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.544 -0.723 . . . . 20.0 111.479 174.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -65.8 -42.71 90.38 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.522 0.729 . . . . 20.0 111.241 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -49.67 -52.14 33.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.161 0.584 . . . . 20.0 111.381 174.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.98 -45.29 94.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.64 0.776 . . . . 20.0 112.796 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -52.56 -41.41 63.53 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.241 1.416 . . . . 20.0 113.184 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.78 8.31 3.82 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.734 1.614 . . . . 20.0 114.183 176.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.31 18.1 53.81 Favored Glycine 0 CA--C 1.532 1.129 0 O-C-N 120.631 -1.293 . . . . 20.0 113.532 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.95 -113.58 3.35 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.377 1.942 . . . . 20.0 112.472 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -53.32 -28.43 43.2 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.284 2.656 . . . . 20.0 113.61 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -55.33 -38.14 68.34 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.951 1.3 . . . . 20.0 112.152 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.7 p -72.44 -9.59 58.73 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 115.324 1.601 . . . . 20.0 115.324 174.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.59 17.43 62.34 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 119.997 1.272 . . . . 20.0 115.569 175.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -106.82 135.24 19.57 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 125.412 1.485 . . . . 20.0 111.316 -176.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.28 125.92 18.98 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.727 2.952 . . . . 20.0 113.281 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.14 135.21 39.49 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.492 2.128 . . . . 20.0 112.309 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.72 98.65 1.16 Allowed 'Trans proline' 0 CA--C 1.537 0.625 0 C-N-CA 123.738 2.958 . . . . 20.0 111.254 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.862 -1.542 . . . . 20.0 111.225 174.171 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 118.08 -0.962 . . . . 20.0 110.841 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -52.88 -32.4 44.85 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.032 1.493 . . . . 20.0 115.032 -171.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -60.38 -32.09 70.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.524 1.13 . . . . 20.0 113.266 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.5 98.76 Favored 'General case' 0 CA--C 1.537 0.442 0 O-C-N 121.891 -0.505 . . . . 20.0 110.683 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -41.9 75.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.248 1.019 . . . . 20.0 111.383 175.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.2 t90 -51.86 -51.14 58.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.633 0.773 . . . . 20.0 112.244 175.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.48 -36.48 82.63 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.943 0.72 . . . . 20.0 112.943 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -60.21 -33.32 72.09 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.683 1.193 . . . . 20.0 113.582 -177.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -83.24 3.68 30.15 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.983 1.313 . . . . 20.0 113.447 173.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.48 16.27 34.97 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 120.95 -1.094 . . . . 20.0 114.023 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.14 -107.02 0.84 Allowed Glycine 0 CA--C 1.533 1.194 0 C-N-CA 126.852 2.168 . . . . 20.0 113.277 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -55.66 -30.04 73.48 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.535 2.157 . . . . 20.0 113.508 172.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -57.35 -36.01 70.66 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.082 1.353 . . . . 20.0 112.473 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -15.85 61.78 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.931 1.692 . . . . 20.0 113.245 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.88 4.14 13.35 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.129 1.347 . . . . 20.0 115.744 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -79.88 136.03 55.0 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 125.672 1.589 . . . . 20.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_exo -44.71 121.21 3.22 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.193 3.262 . . . . 20.0 113.564 173.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.61 124.73 12.78 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.927 2.418 . . . . 20.0 110.589 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.9 156.39 48.01 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 121.887 1.725 . . . . 20.0 110.879 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.9 p . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.153 1.781 . . . . 20.0 111.288 177.015 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 114.313 1.227 . . . . 20.0 114.313 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.0 -31.68 69.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.081 -1.637 . . . . 20.0 113.97 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.29 -32.84 74.36 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.649 0.779 . . . . 20.0 112.623 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.2 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.676 0.791 . . . . 20.0 111.386 173.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -66.59 -45.57 78.81 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.562 -0.732 . . . . 20.0 110.946 175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -48.55 -49.29 36.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.531 0.732 . . . . 20.0 112.63 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.32 -46.54 85.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.006 0.522 . . . . 20.0 112.398 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -55.53 -32.21 62.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.627 1.171 . . . . 20.0 113.637 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -82.16 17.46 1.63 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.168 1.387 . . . . 20.0 114.252 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.61 27.9 37.37 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.331 1.443 . . . . 20.0 112.846 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -115.21 4.78 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.263 1.411 . . . . 20.0 111.697 -172.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.93 -8.61 17.9 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.239 1.959 . . . . 20.0 113.519 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.9 m -55.99 -36.45 67.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.899 1.279 . . . . 20.0 113.764 -171.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.07 -4.31 54.82 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.872 2.069 . . . . 20.0 113.514 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.97 -10.83 31.3 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.237 1.399 . . . . 20.0 115.421 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.79 117.65 22.64 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.196 1.799 . . . . 20.0 111.081 172.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.28 137.02 76.06 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 122.973 2.449 . . . . 20.0 112.969 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -66.36 134.31 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.861 2.374 . . . . 20.0 112.6 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.04 103.16 1.44 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.325 2.683 . . . . 20.0 110.142 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.495 1.918 . . . . 20.0 110.513 179.519 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 114.064 1.135 . . . . 20.0 114.064 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.7 -32.36 70.44 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 119.968 -1.707 . . . . 20.0 114.426 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -63.93 -36.62 84.56 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.228 1.011 . . . . 20.0 112.273 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.62 82.46 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 122.969 0.508 . . . . 20.0 110.495 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -67.05 -38.82 86.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.452 0.538 . . . . 20.0 112.452 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.44 ' CD1' ' HD2' ' A' ' 16' ' ' ARG . 68.2 t90 -52.12 -51.55 57.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.886 0.875 . . . . 20.0 111.152 174.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.41 -45.32 94.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 119.094 -0.479 . . . . 20.0 112.159 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -55.39 -38.73 69.25 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.092 1.145 . . . . 20.0 114.092 -178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.0 5.7 4.03 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.356 1.243 . . . . 20.0 114.356 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.59 37.35 Favored Glycine 0 CA--C 1.531 1.084 0 O-C-N 120.616 -1.303 . . . . 20.0 112.913 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.99 -113.16 3.37 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.38 1.943 . . . . 20.0 112.523 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.78 -28.24 56.6 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.494 2.796 . . . . 20.0 114.131 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.5 m -52.47 -37.81 57.95 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 20.0 112.194 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -24.03 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.412 2.285 . . . . 20.0 114.578 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.61 1.66 Allowed Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.505 1.526 . . . . 20.0 116.884 -172.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD2' ' CD1' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -64.45 132.34 95.34 Favored Pre-proline 0 N--CA 1.476 0.838 0 CA-C-N 119.956 1.878 . . . . 20.0 111.281 174.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.5 126.81 18.8 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.503 2.802 . . . . 20.0 112.319 171.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -64.36 138.53 61.0 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.191 1.928 . . . . 20.0 111.501 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.19 150.98 48.58 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.305 2.003 . . . . 20.0 110.764 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t . . . . . 0 C--O 1.253 1.253 0 C-N-CA 125.29 1.436 . . . . 20.0 110.915 174.8 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.2 t70 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 108.634 -0.876 . . . . 20.0 108.634 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.67 -33.81 0.38 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.861 0.864 . . . . 20.0 112.92 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.34 -34.98 71.22 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.881 0.872 . . . . 20.0 112.821 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.73 -50.3 72.64 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 20.0 111.032 174.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -70.26 -33.84 72.08 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.545 0.738 . . . . 20.0 112.389 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -52.19 -55.19 22.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.767 0.827 . . . . 20.0 110.746 172.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.01 -47.15 87.78 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.829 -0.605 . . . . 20.0 112.331 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -39.53 70.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.549 0.74 . . . . 20.0 112.822 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -85.58 32.05 0.58 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.051 1.74 . . . . 20.0 112.379 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.73 27.29 54.4 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.396 0.998 . . . . 20.0 114.138 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.89 -116.92 8.92 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 118.087 0.943 . . . . 20.0 111.498 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.53 -14.95 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.062 1.842 . . . . 20.0 113.534 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -61.29 -23.64 65.84 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.284 1.216 . . . . 20.0 114.284 -174.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -3.23 33.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.733 1.213 . . . . 20.0 113.894 175.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.72 8.38 87.74 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.727 1.149 . . . . 20.0 114.87 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -97.65 127.35 37.89 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 125.664 1.586 . . . . 20.0 110.59 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -52.15 140.04 51.69 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.672 2.248 . . . . 20.0 112.377 172.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.52 130.4 28.12 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 122.634 2.223 . . . . 20.0 111.196 175.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -73.2 156.92 50.92 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.175 1.917 . . . . 20.0 110.799 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.248 0.996 0 C-N-CA 126.033 1.733 . . . . 20.0 109.634 -177.305 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 112.844 0.683 . . . . 20.0 112.844 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.36 -26.86 68.66 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.262 1.025 . . . . 20.0 113.134 175.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.6 -34.91 73.35 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.91 0.884 . . . . 20.0 112.454 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.73 -31.31 72.21 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.8 0.84 . . . . 20.0 112.636 175.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -43.11 20.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.955 0.902 . . . . 20.0 110.571 171.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -48.0 -52.54 19.51 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.513 1.125 . . . . 20.0 112.316 176.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.4 mt -60.73 -39.05 87.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -59.17 -41.49 88.53 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.926 1.69 . . . . 20.0 111.954 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -76.01 28.66 0.11 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 126.683 1.993 . . . . 20.0 114.15 172.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.18 28.28 66.61 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 125.155 1.359 . . . . 20.0 113.698 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.76 -117.09 6.75 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.97 1.271 . . . . 20.0 111.56 -173.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -75.82 -10.81 20.01 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.04 1.827 . . . . 20.0 113.396 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -54.8 -39.58 68.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.308 1.043 . . . . 20.0 113.252 -173.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.7 m -75.81 -8.9 57.99 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.584 1.327 . . . . 20.0 114.584 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.01 -10.72 46.25 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 115.973 1.149 . . . . 20.0 115.973 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -58.7 122.84 64.31 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 118.93 1.365 . . . . 20.0 111.127 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -54.19 136.38 67.85 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.003 2.469 . . . . 20.0 112.931 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.64 130.26 24.45 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.783 2.322 . . . . 20.0 111.752 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -73.03 124.6 9.71 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.727 2.284 . . . . 20.0 109.766 176.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 p . . . . . 0 C--O 1.252 1.231 0 CA-C-O 116.862 -1.542 . . . . 20.0 110.41 175.404 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 N--CA 1.488 1.475 0 N-CA-C 114.741 1.386 . . . . 20.0 114.741 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.44 10.02 13.46 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.54 -1.35 . . . . 20.0 114.194 -174.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.14 -37.63 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.5 1.12 . . . . 20.0 113.458 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.33 -45.44 91.34 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.635 -0.665 . . . . 20.0 111.372 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -66.92 -35.22 79.5 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.408 0.683 . . . . 20.0 111.836 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.7 t90 -58.26 -52.08 67.07 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.191 -0.943 . . . . 20.0 111.268 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -59.14 -44.62 92.06 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.371 0.668 . . . . 20.0 112.657 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -38.06 53.66 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.52 1.128 . . . . 20.0 113.596 176.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -83.63 26.49 0.68 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.956 1.702 . . . . 20.0 113.44 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.08 26.01 65.23 Favored Glycine 0 CA--C 1.531 1.066 0 O-C-N 121.09 -1.006 . . . . 20.0 112.986 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.14 -115.05 4.2 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.078 1.323 . . . . 20.0 111.65 -174.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -75.0 -9.72 20.9 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.209 1.939 . . . . 20.0 113.345 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 t -62.2 -34.01 75.65 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.711 1.004 . . . . 20.0 113.711 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.0 m -78.37 0.14 26.81 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.007 1.114 . . . . 20.0 114.007 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.25 14.23 82.53 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 119.432 1.015 . . . . 20.0 114.939 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -98.43 123.31 50.81 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 126.143 1.777 . . . . 20.0 110.239 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.74 138.63 59.51 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.917 2.411 . . . . 20.0 112.553 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.47 136.3 49.9 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.718 2.279 . . . . 20.0 111.928 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -79.13 115.59 3.53 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.404 2.736 . . . . 20.0 110.933 177.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.5 m . . . . . 0 C--O 1.251 1.145 0 C-N-CA 125.601 1.56 . . . . 20.0 110.996 169.079 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.8 t0 . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 109.305 -0.628 . . . . 20.0 109.305 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.17 -30.74 9.04 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.685 0.794 . . . . 20.0 112.523 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -64.27 -34.61 78.51 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.597 0.759 . . . . 20.0 111.95 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.14 -46.18 72.18 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.135 0.42 . . . . 20.0 112.135 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -67.08 -42.37 84.78 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.511 0.596 . . . . 20.0 111.958 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -53.91 -47.69 70.92 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.79 0.436 . . . . 20.0 111.408 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.07 -41.78 97.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.929 0.714 . . . . 20.0 112.929 171.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -54.77 -42.62 71.93 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.514 1.126 . . . . 20.0 112.904 177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.27 -6.97 38.68 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.288 1.435 . . . . 20.0 113.822 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.7 2.89 37.25 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.499 1.523 . . . . 20.0 115.461 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 45.68 -109.39 0.32 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.566 2.031 . . . . 20.0 114.066 -178.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -54.88 -34.04 84.21 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.799 2.333 . . . . 20.0 113.681 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 m -66.6 -29.78 69.91 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.514 0.725 . . . . 20.0 112.819 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.27 -18.32 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.326 1.05 . . . . 20.0 112.704 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.93 5.69 53.37 Favored Glycine 0 CA--C 1.539 1.553 0 C-N-CA 124.755 1.169 . . . . 20.0 115.461 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -78.82 132.98 62.79 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.183 1.393 . . . . 20.0 110.548 178.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -41.94 121.65 1.85 Allowed 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.452 3.435 . . . . 20.0 114.183 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -67.32 128.58 18.62 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.321 2.681 . . . . 20.0 112.057 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.23 89.3 1.33 Allowed 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.033 2.488 . . . . 20.0 111.024 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p . . . . . 0 C--O 1.258 1.521 0 CA-C-O 114.656 -2.593 . . . . 20.0 110.96 176.85 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.6 t70 . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 117.557 -1.211 . . . . 20.0 108.78 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 51.4 -6.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 118.191 2.663 . . . . 20.0 118.191 -176.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.71 -33.95 73.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.821 2.048 . . . . 20.0 114.117 -170.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.9 87.44 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.773 -0.579 . . . . 20.0 111.103 174.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.65 -45.13 88.06 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.554 0.741 . . . . 20.0 111.137 175.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.2 t90 -50.15 -48.8 53.65 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.807 0.843 . . . . 20.0 111.67 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.35 -54.44 43.71 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 118.487 -0.768 . . . . 20.0 112.099 171.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -52.49 -37.56 57.52 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.081 1.141 . . . . 20.0 114.081 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -71.66 -11.88 61.06 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.994 1.109 . . . . 20.0 113.994 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.98 22.31 3.93 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.683 1.135 . . . . 20.0 114.076 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.79 -129.66 45.2 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 118.227 1.013 . . . . 20.0 111.095 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.76 -15.58 37.15 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.469 2.113 . . . . 20.0 112.696 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 t -62.52 -15.39 50.23 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.488 0.921 . . . . 20.0 113.488 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -77.69 -10.42 59.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.482 1.513 . . . . 20.0 113.55 177.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.12 12.4 84.66 Favored Glycine 0 CA--C 1.538 1.474 0 CA-C-N 119.104 0.866 . . . . 20.0 114.922 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.17 126.48 29.59 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.869 1.668 . . . . 20.0 110.516 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -52.13 140.74 50.12 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.387 2.725 . . . . 20.0 113.282 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.81 126.75 17.22 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.437 2.758 . . . . 20.0 112.171 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.7 64.08 8.81 Favored 'Trans proline' 0 CA--C 1.548 1.179 0 C-N-CA 123.294 2.662 . . . . 20.0 111.889 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 C--O 1.248 1.002 0 C-N-CA 127.209 2.204 . . . . 20.0 110.995 173.345 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 109.802 -0.444 . . . . 20.0 109.802 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.7 -17.08 14.04 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.883 0.873 . . . . 20.0 113.334 172.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -65.17 -38.82 91.77 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.627 0.771 . . . . 20.0 112.586 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.49 -44.54 85.03 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.802 0.728 . . . . 20.0 112.092 172.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.5 -43.0 77.78 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.967 -0.458 . . . . 20.0 111.67 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -51.88 -48.05 64.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.354 0.661 . . . . 20.0 111.348 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.02 -47.07 87.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 117.948 -1.025 . . . . 20.0 112.806 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -52.97 -40.8 64.0 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.704 1.138 . . . . 20.0 112.816 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -73.16 19.34 0.09 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 125.06 1.344 . . . . 20.0 113.616 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 26.13 47.96 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 126.562 2.03 . . . . 20.0 113.091 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.64 -115.97 4.36 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.77 1.176 . . . . 20.0 111.241 -170.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.75 -9.21 19.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.039 1.826 . . . . 20.0 113.504 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -59.8 -27.82 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.798 1.407 . . . . 20.0 114.798 -173.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -6.09 58.02 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.174 1.39 . . . . 20.0 113.165 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.01 -12.51 42.83 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.755 1.169 . . . . 20.0 115.511 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -58.98 119.42 37.79 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 125.589 1.556 . . . . 20.0 111.037 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.09 135.08 58.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.123 2.549 . . . . 20.0 112.783 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -63.51 139.26 69.46 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.545 2.163 . . . . 20.0 112.635 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.72 107.5 2.38 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.379 2.719 . . . . 20.0 111.056 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 C--O 1.247 0.94 0 C-N-CA 125.745 1.618 . . . . 20.0 110.821 176.321 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 118.583 -0.722 . . . . 20.0 111.746 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.18 -27.38 3.54 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.734 1.754 . . . . 20.0 115.734 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.66 -32.47 69.13 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.033 1.333 . . . . 20.0 113.359 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.13 -45.38 94.91 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.269 0.628 . . . . 20.0 111.06 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -68.61 -42.79 77.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.186 -0.435 . . . . 20.0 111.364 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -51.04 -49.84 59.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.329 0.652 . . . . 20.0 111.628 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.18 -47.74 84.68 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.97 0.73 . . . . 20.0 112.97 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.14 -38.67 65.73 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.152 0.887 . . . . 20.0 112.883 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -78.46 18.86 0.51 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.749 1.62 . . . . 20.0 113.549 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.12 23.61 37.33 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.589 1.566 . . . . 20.0 113.626 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.24 -116.93 7.49 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.861 1.22 . . . . 20.0 110.978 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.06 -9.89 20.88 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.106 1.871 . . . . 20.0 113.541 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 t -56.62 -36.64 69.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.536 1.062 . . . . 20.0 113.427 -175.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -8.01 52.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.384 1.473 . . . . 20.0 113.97 176.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.98 2.94 59.07 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.663 1.12 . . . . 20.0 115.248 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -74.11 133.82 78.08 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.029 1.332 . . . . 20.0 110.939 179.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -44.49 121.2 3.09 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.334 3.356 . . . . 20.0 113.634 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.53 118.38 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.229 2.619 . . . . 20.0 110.735 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.3 150.61 47.38 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 121.612 1.541 . . . . 20.0 110.511 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.252 1.219 0 C-N-CA 126.024 1.73 . . . . 20.0 109.459 174.816 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 108.811 -0.811 . . . . 20.0 108.811 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.58 7.6 2.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.467 1.107 . . . . 20.0 113.404 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -61.17 -39.89 91.84 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.709 1.204 . . . . 20.0 112.599 -172.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.83 78.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.885 0.874 . . . . 20.0 111.637 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -71.04 -41.83 70.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.161 0.584 . . . . 20.0 111.27 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.8 t90 -51.05 -48.59 61.51 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.836 0.854 . . . . 20.0 111.603 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.75 -43.21 94.39 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 118.723 -0.656 . . . . 20.0 112.65 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -57.18 -35.69 69.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.22 0.918 . . . . 20.0 113.366 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -73.42 13.31 0.47 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.304 1.224 . . . . 20.0 114.304 171.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 21.3 59.95 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.16 -1.587 . . . . 20.0 112.81 -175.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.3 -120.54 16.22 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.246 1.403 . . . . 20.0 111.805 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.7 -10.22 20.04 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.391 2.061 . . . . 20.0 113.208 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 t -72.94 -19.86 61.17 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.93 1.085 . . . . 20.0 113.93 -171.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.2 m -92.85 14.94 15.91 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.653 1.181 . . . . 20.0 113.969 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.48 14.36 74.67 Favored Glycine 0 CA--C 1.536 1.38 0 O-C-N 121.17 -0.956 . . . . 20.0 114.422 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -104.02 126.81 30.72 Favored Pre-proline 0 C--N 1.35 0.614 0 C-N-CA 125.099 1.36 . . . . 20.0 110.078 -171.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.0 144.5 47.59 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.241 1.961 . . . . 20.0 111.473 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.74 136.4 35.71 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.693 2.262 . . . . 20.0 111.779 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -79.9 72.37 6.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.767 2.978 . . . . 20.0 110.948 178.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 116.791 -1.576 . . . . 20.0 111.272 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 112.534 0.568 . . . . 20.0 112.534 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.65 1.15 55.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.657 1.183 . . . . 20.0 113.218 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -56.55 -42.1 77.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.33 1.452 . . . . 20.0 113.724 -174.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -48.82 74.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.054 0.942 . . . . 20.0 111.731 174.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.39 -43.47 81.27 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.661 0.384 . . . . 20.0 111.419 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -50.72 -50.48 55.17 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.958 0.903 . . . . 20.0 111.561 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.51 -44.46 97.04 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.638 0.607 . . . . 20.0 112.638 173.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -57.52 -34.92 69.6 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 20.0 113.572 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.82 -6.13 47.32 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 172.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.92 11.05 29.09 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.79 1.186 . . . . 20.0 114.224 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.68 -109.5 0.83 Allowed Glycine 0 CA--C 1.533 1.199 0 C-N-CA 126.523 2.011 . . . . 20.0 113.168 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -54.91 -31.66 74.44 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.713 2.275 . . . . 20.0 113.772 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -56.8 -38.07 72.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.163 0.985 . . . . 20.0 112.271 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -18.21 63.02 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.282 1.433 . . . . 20.0 113.635 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.99 3.73 12.09 Favored Glycine 0 CA--C 1.541 1.713 0 C-N-CA 124.945 1.259 . . . . 20.0 115.905 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 136.53 71.3 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.553 1.541 . . . . 20.0 110.003 177.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -45.36 120.91 3.44 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.177 3.251 . . . . 20.0 113.561 168.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.76 133.21 25.01 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.86 2.373 . . . . 20.0 111.943 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -78.27 80.34 3.04 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.351 2.7 . . . . 20.0 109.894 173.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.257 1.478 0 CA-C-O 112.894 -3.431 . . . . 20.0 114.437 176.501 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 21.2 t0 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.699 -0.852 . . . . 20.0 108.699 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.53 7.18 1.7 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.82 1.248 . . . . 20.0 113.195 173.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.71 -34.69 67.29 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.356 -0.84 . . . . 20.0 112.135 -170.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.57 70.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.43 0.692 . . . . 20.0 110.852 172.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -65.83 -41.26 92.01 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.825 0.85 . . . . 20.0 112.034 177.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -49.75 -51.47 38.78 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.399 0.545 . . . . 20.0 111.309 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.07 -50.37 72.23 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.853 -0.594 . . . . 20.0 112.063 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.8 tptp -56.34 -37.09 69.53 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.348 1.24 . . . . 20.0 114.348 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.32 -7.14 47.92 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.817 1.247 . . . . 20.0 114.357 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.49 23.02 4.57 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.419 1.009 . . . . 20.0 113.917 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.09 -127.74 43.95 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 118.197 0.999 . . . . 20.0 111.61 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.61 -14.69 36.93 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.077 2.518 . . . . 20.0 113.399 -174.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.6 m -70.44 -1.86 12.07 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.933 1.086 . . . . 20.0 113.933 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 m -91.63 6.04 47.33 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.998 1.719 . . . . 20.0 113.666 -170.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.9 12.99 79.07 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.552 1.072 . . . . 20.0 114.882 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -127.35 122.28 22.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.572 1.949 . . . . 20.0 110.679 -175.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.68 150.78 21.03 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.241 2.627 . . . . 20.0 113.784 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.22 115.06 2.76 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.083 3.189 . . . . 20.0 112.242 176.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -79.31 65.93 8.82 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.363 2.709 . . . . 20.0 110.839 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.1 t . . . . . 0 C--O 1.257 1.448 0 CA-C-O 112.627 -3.558 . . . . 20.0 114.999 -179.65 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 CA-C-O 118.413 -0.803 . . . . 20.0 112.509 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.75 13.6 12.06 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.389 1.255 . . . . 20.0 114.389 -168.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -57.91 -43.04 85.94 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.305 1.442 . . . . 20.0 113.62 -171.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.08 -45.03 79.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.834 0.853 . . . . 20.0 111.873 173.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -42.99 69.72 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.841 0.856 . . . . 20.0 111.661 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -51.07 -49.82 59.9 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.209 1.404 . . . . 20.0 111.645 174.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.93 -44.78 96.07 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.026 0.53 . . . . 20.0 112.138 173.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -56.08 -41.25 74.86 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.603 1.161 . . . . 20.0 112.943 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -69.7 -8.32 46.8 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.746 1.218 . . . . 20.0 113.949 174.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.04 8.21 39.54 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.897 1.237 . . . . 20.0 115.303 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 48.33 -110.0 0.6 Allowed Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.539 2.019 . . . . 20.0 113.814 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.74 -28.53 67.07 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.796 2.33 . . . . 20.0 114.029 176.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 t -69.77 -29.96 67.41 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.664 0.786 . . . . 20.0 112.942 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.73 -21.25 38.03 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.535 1.134 . . . . 20.0 112.622 -176.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.03 -14.43 20.65 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.856 1.693 . . . . 20.0 115.665 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 129.48 92.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 118.875 1.337 . . . . 20.0 111.029 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.54 135.17 60.7 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.08 2.52 . . . . 20.0 112.669 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.37 134.91 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.672 2.248 . . . . 20.0 112.291 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -79.66 112.61 2.95 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.603 2.869 . . . . 20.0 110.878 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.994 1.718 . . . . 20.0 110.784 179.577 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.475 0.777 0 CA-C-O 118.661 -0.685 . . . . 20.0 109.677 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.86 8.04 5.13 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 116.27 1.952 . . . . 20.0 116.27 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -63.04 -36.79 84.75 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 113.823 1.045 . . . . 20.0 113.823 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.7 88.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.827 -0.546 . . . . 20.0 111.109 174.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -68.07 -42.39 80.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.003 0.521 . . . . 20.0 111.779 175.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -49.92 -47.79 52.1 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.237 0.615 . . . . 20.0 112.068 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.2 -44.89 94.08 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.318 0.858 . . . . 20.0 113.318 174.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -53.49 -39.45 64.56 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.372 1.069 . . . . 20.0 113.023 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.94 16.24 0.32 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 124.658 1.183 . . . . 20.0 114.037 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.63 27.98 40.65 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 120.027 -1.67 . . . . 20.0 112.662 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.4 -118.13 11.74 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.531 1.539 . . . . 20.0 111.985 -176.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -75.02 -7.07 18.82 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.392 2.061 . . . . 20.0 113.178 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -56.65 -34.84 67.73 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.701 1.2 . . . . 20.0 113.367 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.11 -8.35 37.47 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.612 1.565 . . . . 20.0 114.736 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.86 3.33 90.52 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-N 119.219 0.918 . . . . 20.0 114.437 -173.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -89.5 134.29 32.88 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 124.734 1.214 . . . . 20.0 110.477 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -72.3 152.81 55.95 Favored 'Trans proline' 0 CA--C 1.547 1.154 0 C-N-CA 122.097 1.865 . . . . 20.0 112.314 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.62 124.41 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.97 3.113 . . . . 20.0 111.99 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -81.1 88.34 1.39 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.373 2.715 . . . . 20.0 112.085 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 C--O 1.245 0.849 0 C-N-CA 126.15 1.78 . . . . 20.0 111.707 179.442 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 118.266 -0.873 . . . . 20.0 108.868 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.3 -0.02 11.6 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.713 1.205 . . . . 20.0 113.297 177.167 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.33 -39.64 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.403 1.081 . . . . 20.0 111.771 -175.003 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.58 85.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.242 0.617 . . . . 20.0 111.836 173.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -44.83 86.47 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.291 0.636 . . . . 20.0 111.182 176.019 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -52.19 -46.91 65.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.024 0.529 . . . . 20.0 112.123 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -41.13 98.73 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.957 0.725 . . . . 20.0 112.957 174.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -39.66 66.97 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.133 0.973 . . . . 20.0 112.878 177.697 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -82.96 25.75 0.66 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.547 1.539 . . . . 20.0 113.988 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.71 27.31 59.12 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.938 1.256 . . . . 20.0 113.031 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.92 -115.39 6.41 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.22 1.39 . . . . 20.0 111.465 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -77.24 -5.96 16.12 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 122.292 1.994 . . . . 20.0 113.49 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.3 m -58.22 -34.06 70.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.63 1.172 . . . . 20.0 113.625 -173.446 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -5.03 44.74 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.403 1.881 . . . . 20.0 113.642 176.603 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.66 8.14 86.07 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.495 1.043 . . . . 20.0 114.913 -177.676 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -83.41 131.99 51.15 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.69 1.596 . . . . 20.0 110.471 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.09 140.18 48.83 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.005 1.804 . . . . 20.0 111.107 174.065 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.62 143.23 61.54 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.832 2.355 . . . . 20.0 111.942 178.558 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.51 112.32 3.32 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.344 2.696 . . . . 20.0 110.87 177.047 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 126.944 2.098 . . . . 20.0 110.355 176.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.788 0.292 . . . . 20.0 111.788 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.36 -29.31 70.38 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.826 0.676 . . . . 20.0 112.826 176.681 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -59.03 -35.36 73.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.608 0.763 . . . . 20.0 112.472 177.69 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.63 88.6 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.325 0.65 . . . . 20.0 111.734 176.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.85 -42.3 63.88 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.975 0.51 . . . . 20.0 111.195 175.372 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.7 t90 -54.5 -44.14 72.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.798 . . . . 20.0 112.103 177.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -62.02 -39.22 91.56 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.596 -0.69 . . . . 20.0 112.652 174.822 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -30.44 63.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.083 1.353 . . . . 20.0 112.323 176.677 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -85.73 18.57 2.82 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.688 1.195 . . . . 20.0 113.018 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.82 27.38 67.05 Favored Glycine 0 C--N 1.348 1.204 0 C-N-CA 125.796 1.665 . . . . 20.0 113.003 -173.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.81 -118.44 14.67 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.185 0.898 . . . . 20.0 111.462 -176.181 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -81.3 6.08 5.83 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.05 2.5 . . . . 20.0 113.677 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.3 p -68.87 -33.96 74.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.054 1.297 . . . . 20.0 113.468 -177.318 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -10.29 59.61 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.148 0.979 . . . . 20.0 113.031 177.285 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.09 16.26 79.04 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 123.771 0.7 . . . . 20.0 114.025 -176.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.16 133.58 31.5 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 125.338 1.455 . . . . 20.0 110.927 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.66 135.18 37.78 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.095 1.863 . . . . 20.0 111.392 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.0 136.44 65.51 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.61 2.874 . . . . 20.0 112.261 177.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -82.77 82.76 2.12 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.778 2.985 . . . . 20.0 111.39 -179.248 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 56.5 m . . . . . 0 C--O 1.248 1.006 0 CA-C-O 116.896 -1.526 . . . . 20.0 111.515 -179.327 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 119.24 -0.41 . . . . 20.0 111.105 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.97 4.28 2.5 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.457 1.103 . . . . 20.0 113.555 176.216 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.83 -37.5 87.6 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.466 1.106 . . . . 20.0 113.18 -172.385 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.33 -47.04 82.58 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.352 0.661 . . . . 20.0 111.294 175.338 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -67.02 -42.31 85.14 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.648 0.779 . . . . 20.0 111.588 175.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -50.29 -50.84 49.25 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.864 0.866 . . . . 20.0 111.597 175.399 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.52 -45.19 94.72 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 119.154 -0.45 . . . . 20.0 112.163 173.061 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -54.09 -39.71 66.6 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.754 1.222 . . . . 20.0 113.095 178.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -75.39 12.64 0.92 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.547 1.539 . . . . 20.0 113.674 177.845 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.27 27.96 31.86 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 120.423 -1.423 . . . . 20.0 112.762 -176.511 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.19 -117.25 10.46 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.567 1.556 . . . . 20.0 111.882 -177.207 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.98 -7.4 19.15 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.404 2.069 . . . . 20.0 113.364 -179.696 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.2 m -54.96 -34.24 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.772 1.229 . . . . 20.0 113.505 -174.64 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.02 -9.42 52.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.68 1.992 . . . . 20.0 114.474 176.248 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.14 8.96 87.01 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.086 0.857 . . . . 20.0 114.466 -174.127 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -92.35 131.23 35.04 Favored Pre-proline 0 CA--C 1.539 0.558 0 C-N-CA 125.017 1.327 . . . . 20.0 110.628 178.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -65.34 149.74 87.96 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 121.938 1.758 . . . . 20.0 112.176 174.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.45 128.34 16.17 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.827 3.018 . . . . 20.0 112.068 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -78.04 88.76 1.4 Allowed 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.523 2.815 . . . . 20.0 111.185 -178.653 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.251 1.173 0 CA-C-O 116.661 -1.637 . . . . 20.0 111.188 177.355 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 117.926 -1.035 . . . . 20.0 111.27 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.06 -0.05 23.21 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.594 1.331 . . . . 20.0 114.594 -172.47 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.37 -37.62 85.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.694 1.198 . . . . 20.0 113.438 -174.271 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.24 -44.75 88.41 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.314 0.646 . . . . 20.0 111.249 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -66.75 -41.31 88.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.006 0.522 . . . . 20.0 111.56 175.665 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 t90 -53.52 -49.45 67.56 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.215 0.461 . . . . 20.0 111.751 174.035 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.53 -40.95 98.43 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 118.585 -0.721 . . . . 20.0 112.923 174.421 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -53.55 -36.09 61.45 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.039 1.126 . . . . 20.0 114.039 176.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -79.77 10.83 3.66 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.728 1.211 . . . . 20.0 113.642 175.792 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.45 25.75 32.3 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 120.51 -1.369 . . . . 20.0 112.698 -176.319 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.39 -114.93 6.0 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.251 1.405 . . . . 20.0 111.772 -177.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.17 -6.51 15.76 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.261 1.974 . . . . 20.0 113.472 -179.553 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -56.59 -40.29 75.02 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.58 1.082 . . . . 20.0 113.478 -175.352 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -7.68 21.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 127.409 2.284 . . . . 20.0 114.909 174.364 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.26 10.94 84.41 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.714 1.143 . . . . 20.0 114.481 -175.75 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -90.44 134.34 31.25 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 125.322 1.449 . . . . 20.0 110.628 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.71 143.77 57.33 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.037 1.825 . . . . 20.0 111.582 178.143 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.04 141.72 49.0 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.05 2.5 . . . . 20.0 111.482 177.264 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.07 129.48 10.57 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.895 2.397 . . . . 20.0 111.003 177.166 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.1 p . . . . . 0 C--O 1.259 1.582 0 CA-C-O 114.816 -2.516 . . . . 20.0 110.641 175.71 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 25.1 p-10 . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 119.147 -0.454 . . . . 20.0 110.94 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.56 5.57 12.69 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.014 1.726 . . . . 20.0 114.658 -171.383 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.06 -37.63 85.71 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.001 1.32 . . . . 20.0 113.299 -172.102 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.18 88.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.352 0.661 . . . . 20.0 111.48 174.043 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -69.27 -42.32 75.69 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.457 0.703 . . . . 20.0 111.512 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -49.82 -51.64 38.29 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.868 0.867 . . . . 20.0 111.851 172.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.79 -46.02 90.5 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 118.822 -0.609 . . . . 20.0 112.545 173.875 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -52.68 -43.28 65.47 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.844 0.858 . . . . 20.0 113.075 175.899 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -71.25 17.03 0.08 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.298 1.439 . . . . 20.0 114.01 175.237 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.68 21.28 56.47 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 120.007 -1.683 . . . . 20.0 113.163 -178.689 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.99 -120.53 15.34 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.364 1.459 . . . . 20.0 111.706 -177.626 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.44 -9.13 21.36 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.351 2.034 . . . . 20.0 113.388 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 t -76.07 -12.69 60.17 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.442 1.275 . . . . 20.0 114.442 -171.987 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 m -95.3 15.74 18.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.41 1.084 . . . . 20.0 113.885 179.696 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.26 16.41 73.25 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.261 -0.9 . . . . 20.0 114.088 177.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -112.91 128.05 26.09 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 125.485 1.514 . . . . 20.0 110.429 -170.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.35 146.68 51.17 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.156 1.904 . . . . 20.0 111.696 -176.175 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.84 130.96 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.22 2.613 . . . . 20.0 112.091 178.83 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -73.93 96.68 0.94 Allowed 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.436 2.757 . . . . 20.0 110.379 178.011 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 116.889 -1.529 . . . . 20.0 111.205 174.479 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.472 0.64 0 CA-C-O 117.518 -1.23 . . . . 20.0 108.999 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.58 -35.41 7.06 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.142 1.164 . . . . 20.0 114.142 -177.092 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.35 -35.37 71.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.99 0.916 . . . . 20.0 113.324 -176.838 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.26 -42.11 76.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.386 1.074 . . . . 20.0 112.223 173.26 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -73.54 -40.78 63.73 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.128 0.571 . . . . 20.0 111.126 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -53.93 -47.69 70.97 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.466 0.706 . . . . 20.0 112.242 175.908 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.73 -39.69 81.6 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.853 0.686 . . . . 20.0 112.853 174.585 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -34.08 69.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.038 1.335 . . . . 20.0 112.742 177.954 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -84.09 24.57 0.92 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.292 1.837 . . . . 20.0 113.241 174.237 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.06 24.63 76.22 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 120.931 -1.106 . . . . 20.0 112.848 -179.092 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.84 -112.7 2.98 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.458 1.504 . . . . 20.0 111.495 -174.543 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.85 -10.48 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.075 1.85 . . . . 20.0 113.255 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.1 t -58.09 -42.67 86.1 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.37 0.986 . . . . 20.0 113.372 -174.473 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.9 m -70.73 3.0 3.5 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.887 1.439 . . . . 20.0 114.887 174.539 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.0 9.61 85.28 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.188 1.358 . . . . 20.0 114.547 178.274 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -89.12 129.33 48.38 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.538 1.935 . . . . 20.0 109.974 -179.203 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.21 146.65 76.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.857 1.705 . . . . 20.0 111.201 176.302 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.46 134.03 31.97 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.922 2.414 . . . . 20.0 111.746 179.362 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.25 100.64 1.39 Allowed 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.324 2.683 . . . . 20.0 110.871 176.632 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.2 m . . . . . 0 C--O 1.25 1.08 0 CA-C-O 116.455 -1.736 . . . . 20.0 111.849 167.72 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.07 7.2 2.01 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.271 1.028 . . . . 20.0 113.345 171.807 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.01 -38.79 87.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.602 1.161 . . . . 20.0 113.075 -173.449 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.37 -33.01 73.89 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.793 0.837 . . . . 20.0 112.718 176.303 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -76.76 -43.69 35.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.633 0.773 . . . . 20.0 110.673 172.573 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -50.02 -50.44 47.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.379 0.672 . . . . 20.0 111.746 175.666 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.54 -39.04 89.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.092 0.775 . . . . 20.0 113.092 173.714 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.09 -41.46 78.93 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.608 1.163 . . . . 20.0 112.338 177.207 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -79.04 18.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.595 1.558 . . . . 20.0 114.151 176.226 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.76 22.11 54.11 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.825 1.202 . . . . 20.0 113.489 178.671 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.82 -116.25 8.73 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.525 1.059 . . . . 20.0 110.751 -175.359 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.69 -10.77 17.06 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.059 1.839 . . . . 20.0 113.646 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.4 m -58.74 -30.04 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.021 1.282 . . . . 20.0 114.196 -175.123 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.19 -3.46 39.69 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.302 1.441 . . . . 20.0 113.562 175.502 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.43 5.88 83.02 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 119.548 1.067 . . . . 20.0 114.489 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -83.09 130.82 55.76 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 126.759 2.023 . . . . 20.0 110.165 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.06 143.83 67.12 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.053 1.835 . . . . 20.0 111.397 174.692 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.95 134.76 33.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.023 2.482 . . . . 20.0 111.568 178.542 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.12 127.46 9.26 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.111 2.541 . . . . 20.0 110.826 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.253 1.249 0 CA-C-O 113.08 -3.343 . . . . 20.0 113.57 172.312 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 117.897 -1.049 . . . . 20.0 111.161 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.12 5.29 0.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 116.949 2.203 . . . . 20.0 116.949 178.263 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -61.21 -41.4 96.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.789 1.635 . . . . 20.0 113.674 -171.33 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.72 80.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.528 0.731 . . . . 20.0 111.739 174.607 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -68.67 -40.63 80.07 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.471 0.708 . . . . 20.0 111.478 177.915 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -53.7 -51.01 64.62 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.276 0.63 . . . . 20.0 111.969 171.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.97 -42.25 89.49 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.633 -0.667 . . . . 20.0 112.357 174.599 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -18.56 48.6 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.225 1.565 . . . . 20.0 115.225 177.0 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -95.89 20.1 10.46 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.302 2.241 . . . . 20.0 112.152 172.788 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.77 24.09 68.07 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 120.734 -1.229 . . . . 20.0 112.709 -177.187 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.51 -114.71 5.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.556 1.074 . . . . 20.0 111.279 -174.177 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -76.83 -9.67 18.23 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 121.935 1.757 . . . . 20.0 113.408 -178.128 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -32.8 70.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.499 1.296 . . . . 20.0 114.499 -175.361 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -79.12 11.03 3.01 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.998 1.11 . . . . 20.0 113.998 175.715 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.3 17.44 79.68 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.057 -1.027 . . . . 20.0 113.984 177.262 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -109.56 131.74 21.72 Favored Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 125.193 1.397 . . . . 20.0 110.238 -172.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -72.26 151.17 54.24 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.994 1.796 . . . . 20.0 111.833 -176.725 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.22 125.67 12.71 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.451 2.767 . . . . 20.0 111.638 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -81.36 111.28 2.34 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.288 2.658 . . . . 20.0 111.66 177.715 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.9 p . . . . . 0 C--O 1.248 1.025 0 C-N-CA 126.058 1.743 . . . . 20.0 110.681 177.12 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 119.104 -0.474 . . . . 20.0 112.056 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.07 -38.48 91.35 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.0 0.818 . . . . 20.0 112.229 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.48 -48.63 74.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.213 0.605 . . . . 20.0 110.813 173.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -67.27 -42.65 83.51 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.253 0.621 . . . . 20.0 112.117 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -47.3 -50.31 21.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.155 1.382 . . . . 20.0 111.984 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.83 -46.23 85.99 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.301 -0.857 . . . . 20.0 112.521 173.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -54.25 -44.17 71.56 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.389 0.995 . . . . 20.0 113.107 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.2 -18.72 65.53 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.536 0.939 . . . . 20.0 113.536 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.52 9.16 10.47 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.869 1.223 . . . . 20.0 115.17 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.16 -112.44 1.3 Allowed Glycine 0 CA--C 1.535 1.315 0 C-N-CA 127.258 2.361 . . . . 20.0 113.695 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.18 -30.4 60.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.246 2.631 . . . . 20.0 113.88 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -60.26 -38.58 83.94 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.007 1.323 . . . . 20.0 111.847 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.42 -18.3 45.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 126.472 1.909 . . . . 20.0 113.229 -174.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.57 -13.64 1.58 Allowed Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.938 1.733 . . . . 20.0 116.368 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -54.66 126.52 57.3 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.077 1.438 . . . . 20.0 111.229 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -52.59 129.71 33.39 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.279 2.653 . . . . 20.0 112.809 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -64.84 140.09 65.37 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.289 1.993 . . . . 20.0 111.941 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.538 0.704 0 C-N-CA 123.244 2.629 . . . . 20.0 110.75 176.183 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 112.463 0.542 . . . . 20.0 112.463 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -63.7 -37.27 86.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.256 0.622 . . . . 20.0 112.158 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.89 79.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.718 0.807 . . . . 20.0 111.032 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -69.75 -38.69 76.89 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.348 0.499 . . . . 20.0 112.348 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 t90 -51.17 -52.59 42.73 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.213 1.005 . . . . 20.0 111.451 174.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.4 -44.42 96.48 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.693 0.627 . . . . 20.0 112.693 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.45 57.79 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.517 1.303 . . . . 20.0 114.517 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.66 15.81 19.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.154 0.982 . . . . 20.0 112.941 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.12 20.98 37.01 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.494 1.045 . . . . 20.0 112.96 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.15 -114.36 3.64 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.197 1.855 . . . . 20.0 111.495 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -52.65 -28.78 38.65 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.092 3.195 . . . . 20.0 114.205 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -54.43 -29.28 48.84 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.079 1.351 . . . . 20.0 112.47 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -20.62 62.95 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.938 1.695 . . . . 20.0 113.55 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.17 17.12 65.49 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 124.703 1.145 . . . . 20.0 115.734 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 139.02 21.22 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 125.36 1.464 . . . . 20.0 111.167 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -52.55 129.38 31.84 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 123.732 2.955 . . . . 20.0 113.124 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -67.23 133.82 31.81 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.721 2.281 . . . . 20.0 111.912 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo . . . . . 0 CA--C 1.54 0.792 0 C-N-CA 123.797 2.998 . . . . 20.0 111.348 -178.228 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 112.576 0.584 . . . . 20.0 112.576 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -64.97 -38.83 92.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.74 1.616 . . . . 20.0 112.503 -176.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.75 -48.16 72.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.763 0.825 . . . . 20.0 111.013 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.32 -43.09 87.17 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.181 0.592 . . . . 20.0 111.68 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 49.4 t90 -53.28 -47.55 69.07 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.045 0.938 . . . . 20.0 112.041 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.99 -46.66 89.85 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 119.111 -0.471 . . . . 20.0 111.746 171.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.814 1.246 . . . . 20.0 113.899 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -67.69 -17.92 64.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.883 1.273 . . . . 20.0 113.632 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 21.37 4.25 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.345 1.45 . . . . 20.0 114.818 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.99 -129.22 38.05 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.548 1.174 . . . . 20.0 111.151 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.42 -10.33 22.13 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 121.952 1.768 . . . . 20.0 113.07 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -59.68 -34.64 73.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.868 1.267 . . . . 20.0 112.994 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.87 -4.51 38.32 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.015 1.726 . . . . 20.0 113.531 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.95 9.89 86.61 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 124.085 0.85 . . . . 20.0 114.795 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -94.55 133.3 27.11 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 125.379 1.472 . . . . 20.0 110.581 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.92 144.71 65.54 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.041 1.828 . . . . 20.0 111.55 176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.59 136.81 40.54 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.884 2.389 . . . . 20.0 111.302 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo . . . . . 0 CA--C 1.537 0.626 0 C-N-CA 122.923 2.415 . . . . 20.0 110.647 175.427 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 113.299 0.852 . . . . 20.0 113.299 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.58 -33.63 70.18 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.848 0.859 . . . . 20.0 112.853 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.34 -48.56 74.01 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.285 1.034 . . . . 20.0 111.803 171.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -67.46 -43.43 81.06 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.836 0.455 . . . . 20.0 110.838 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -47.9 -50.55 26.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.231 1.012 . . . . 20.0 112.029 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.61 -40.54 92.75 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.192 0.812 . . . . 20.0 113.192 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -32.39 66.96 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.446 1.276 . . . . 20.0 114.446 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -77.78 -12.8 60.01 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.502 0.927 . . . . 20.0 113.502 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.24 7.7 34.7 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.348 1.451 . . . . 20.0 114.382 -175.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.85 -113.71 5.31 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.143 -1.365 . . . . 20.0 112.528 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.51 -29.65 60.75 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.38 2.72 . . . . 20.0 114.817 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.9 p -56.39 -39.41 72.92 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.972 0.909 . . . . 20.0 112.887 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -82.8 -16.39 47.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.998 1.319 . . . . 20.0 113.052 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.01 -7.57 3.06 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.379 1.466 . . . . 20.0 116.238 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.48 125.08 51.25 Favored Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 119.195 1.497 . . . . 20.0 110.942 174.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.38 128.43 27.67 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.254 2.636 . . . . 20.0 112.961 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 136.01 42.69 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.383 2.056 . . . . 20.0 111.486 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 N--CA 1.457 -0.641 0 C-N-CA 122.789 2.326 . . . . 20.0 109.569 176.199 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.1 0 N-CA-C 117.379 2.363 . . . . 20.0 117.379 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.07 -38.12 75.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.277 1.431 . . . . 20.0 113.539 -175.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.96 81.64 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.544 -0.723 . . . . 20.0 111.479 174.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -65.8 -42.71 90.38 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.522 0.729 . . . . 20.0 111.241 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -49.67 -52.14 33.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.161 0.584 . . . . 20.0 111.381 174.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.98 -45.29 94.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.64 0.776 . . . . 20.0 112.796 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -52.56 -41.41 63.53 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.241 1.416 . . . . 20.0 113.184 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.78 8.31 3.82 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.734 1.614 . . . . 20.0 114.183 176.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.31 18.1 53.81 Favored Glycine 0 CA--C 1.532 1.129 0 O-C-N 120.631 -1.293 . . . . 20.0 113.532 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.95 -113.58 3.35 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.377 1.942 . . . . 20.0 112.472 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -53.32 -28.43 43.2 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.284 2.656 . . . . 20.0 113.61 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -55.33 -38.14 68.34 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.951 1.3 . . . . 20.0 112.152 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.7 p -72.44 -9.59 58.73 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 115.324 1.601 . . . . 20.0 115.324 174.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.59 17.43 62.34 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 119.997 1.272 . . . . 20.0 115.569 175.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -106.82 135.24 19.57 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 125.412 1.485 . . . . 20.0 111.316 -176.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.28 125.92 18.98 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.727 2.952 . . . . 20.0 113.281 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.14 135.21 39.49 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.492 2.128 . . . . 20.0 112.309 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 CA--C 1.537 0.625 0 C-N-CA 123.738 2.958 . . . . 20.0 111.254 -177.957 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 115.032 1.493 . . . . 20.0 115.032 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -60.38 -32.09 70.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.524 1.13 . . . . 20.0 113.266 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.5 98.76 Favored 'General case' 0 CA--C 1.537 0.442 0 O-C-N 121.891 -0.505 . . . . 20.0 110.683 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -41.9 75.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.248 1.019 . . . . 20.0 111.383 175.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.2 t90 -51.86 -51.14 58.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.633 0.773 . . . . 20.0 112.244 175.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.48 -36.48 82.63 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.943 0.72 . . . . 20.0 112.943 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -60.21 -33.32 72.09 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.683 1.193 . . . . 20.0 113.582 -177.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -83.24 3.68 30.15 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.983 1.313 . . . . 20.0 113.447 173.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.48 16.27 34.97 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 120.95 -1.094 . . . . 20.0 114.023 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.14 -107.02 0.84 Allowed Glycine 0 CA--C 1.533 1.194 0 C-N-CA 126.852 2.168 . . . . 20.0 113.277 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -55.66 -30.04 73.48 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.535 2.157 . . . . 20.0 113.508 172.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -57.35 -36.01 70.66 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.082 1.353 . . . . 20.0 112.473 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -15.85 61.78 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.931 1.692 . . . . 20.0 113.245 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.88 4.14 13.35 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.129 1.347 . . . . 20.0 115.744 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -79.88 136.03 55.0 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 125.672 1.589 . . . . 20.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_exo -44.71 121.21 3.22 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.193 3.262 . . . . 20.0 113.564 173.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.61 124.73 12.78 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.927 2.418 . . . . 20.0 110.589 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 CA--C 1.539 0.77 0 C-N-CA 121.887 1.725 . . . . 20.0 110.879 174.266 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.97 1.1 . . . . 20.0 113.97 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.29 -32.84 74.36 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.649 0.779 . . . . 20.0 112.623 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.2 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.676 0.791 . . . . 20.0 111.386 173.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -66.59 -45.57 78.81 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.562 -0.732 . . . . 20.0 110.946 175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -48.55 -49.29 36.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.531 0.732 . . . . 20.0 112.63 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.32 -46.54 85.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.006 0.522 . . . . 20.0 112.398 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -55.53 -32.21 62.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.627 1.171 . . . . 20.0 113.637 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -82.16 17.46 1.63 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.168 1.387 . . . . 20.0 114.252 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.61 27.9 37.37 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.331 1.443 . . . . 20.0 112.846 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -115.21 4.78 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.263 1.411 . . . . 20.0 111.697 -172.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.93 -8.61 17.9 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.239 1.959 . . . . 20.0 113.519 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.9 m -55.99 -36.45 67.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.899 1.279 . . . . 20.0 113.764 -171.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.07 -4.31 54.82 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.872 2.069 . . . . 20.0 113.514 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.97 -10.83 31.3 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.237 1.399 . . . . 20.0 115.421 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.79 117.65 22.64 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.196 1.799 . . . . 20.0 111.081 172.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.28 137.02 76.06 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 122.973 2.449 . . . . 20.0 112.969 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -66.36 134.31 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.861 2.374 . . . . 20.0 112.6 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 C--N 1.349 0.591 0 C-N-CA 123.325 2.683 . . . . 20.0 110.142 178.356 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 114.426 1.269 . . . . 20.0 114.426 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -63.93 -36.62 84.56 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.228 1.011 . . . . 20.0 112.273 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.62 82.46 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 122.969 0.508 . . . . 20.0 110.495 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -67.05 -38.82 86.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.452 0.538 . . . . 20.0 112.452 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.44 ' CD1' ' HD2' ' A' ' 16' ' ' ARG . 68.2 t90 -52.12 -51.55 57.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.886 0.875 . . . . 20.0 111.152 174.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.41 -45.32 94.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 119.094 -0.479 . . . . 20.0 112.159 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -55.39 -38.73 69.25 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.092 1.145 . . . . 20.0 114.092 -178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.0 5.7 4.03 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.356 1.243 . . . . 20.0 114.356 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.59 37.35 Favored Glycine 0 CA--C 1.531 1.084 0 O-C-N 120.616 -1.303 . . . . 20.0 112.913 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.99 -113.16 3.37 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.38 1.943 . . . . 20.0 112.523 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.78 -28.24 56.6 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.494 2.796 . . . . 20.0 114.131 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.5 m -52.47 -37.81 57.95 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 20.0 112.194 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -24.03 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.412 2.285 . . . . 20.0 114.578 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.61 1.66 Allowed Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.505 1.526 . . . . 20.0 116.884 -172.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD2' ' CD1' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -64.45 132.34 95.34 Favored Pre-proline 0 N--CA 1.476 0.838 0 CA-C-N 119.956 1.878 . . . . 20.0 111.281 174.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.5 126.81 18.8 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.503 2.802 . . . . 20.0 112.319 171.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -64.36 138.53 61.0 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.191 1.928 . . . . 20.0 111.501 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 N--CA 1.457 -0.634 0 C-N-CA 122.305 2.003 . . . . 20.0 110.764 175.775 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.58 0 N-CA-C 112.92 0.711 . . . . 20.0 112.92 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.34 -34.98 71.22 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.881 0.872 . . . . 20.0 112.821 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.73 -50.3 72.64 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 20.0 111.032 174.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -70.26 -33.84 72.08 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.545 0.738 . . . . 20.0 112.389 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -52.19 -55.19 22.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.767 0.827 . . . . 20.0 110.746 172.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.01 -47.15 87.78 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.829 -0.605 . . . . 20.0 112.331 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -39.53 70.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.549 0.74 . . . . 20.0 112.822 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -85.58 32.05 0.58 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.051 1.74 . . . . 20.0 112.379 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.73 27.29 54.4 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.396 0.998 . . . . 20.0 114.138 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.89 -116.92 8.92 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 118.087 0.943 . . . . 20.0 111.498 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.53 -14.95 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.062 1.842 . . . . 20.0 113.534 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -61.29 -23.64 65.84 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.284 1.216 . . . . 20.0 114.284 -174.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -3.23 33.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.733 1.213 . . . . 20.0 113.894 175.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.72 8.38 87.74 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.727 1.149 . . . . 20.0 114.87 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -97.65 127.35 37.89 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 125.664 1.586 . . . . 20.0 110.59 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -52.15 140.04 51.69 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.672 2.248 . . . . 20.0 112.377 172.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.52 130.4 28.12 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 122.634 2.223 . . . . 20.0 111.196 175.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo . . . . . 0 CA--C 1.539 0.728 0 C-N-CA 122.175 1.917 . . . . 20.0 110.799 174.575 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 113.134 0.791 . . . . 20.0 113.134 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.6 -34.91 73.35 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.91 0.884 . . . . 20.0 112.454 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.73 -31.31 72.21 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.8 0.84 . . . . 20.0 112.636 175.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -43.11 20.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.955 0.902 . . . . 20.0 110.571 171.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -48.0 -52.54 19.51 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.513 1.125 . . . . 20.0 112.316 176.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.4 mt -60.73 -39.05 87.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -59.17 -41.49 88.53 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.926 1.69 . . . . 20.0 111.954 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -76.01 28.66 0.11 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 126.683 1.993 . . . . 20.0 114.15 172.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.18 28.28 66.61 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 125.155 1.359 . . . . 20.0 113.698 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.76 -117.09 6.75 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.97 1.271 . . . . 20.0 111.56 -173.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -75.82 -10.81 20.01 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.04 1.827 . . . . 20.0 113.396 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -54.8 -39.58 68.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.308 1.043 . . . . 20.0 113.252 -173.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.7 m -75.81 -8.9 57.99 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.584 1.327 . . . . 20.0 114.584 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.01 -10.72 46.25 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 115.973 1.149 . . . . 20.0 115.973 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -58.7 122.84 64.31 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 118.93 1.365 . . . . 20.0 111.127 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -54.19 136.38 67.85 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.003 2.469 . . . . 20.0 112.931 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.64 130.26 24.45 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.783 2.322 . . . . 20.0 111.752 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 C-N-CA 122.727 2.284 . . . . 20.0 109.766 176.203 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.907 0 N-CA-C 114.194 1.183 . . . . 20.0 114.194 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.14 -37.63 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.5 1.12 . . . . 20.0 113.458 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.33 -45.44 91.34 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.635 -0.665 . . . . 20.0 111.372 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -66.92 -35.22 79.5 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.408 0.683 . . . . 20.0 111.836 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.7 t90 -58.26 -52.08 67.07 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.191 -0.943 . . . . 20.0 111.268 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -59.14 -44.62 92.06 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.371 0.668 . . . . 20.0 112.657 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -38.06 53.66 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.52 1.128 . . . . 20.0 113.596 176.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -83.63 26.49 0.68 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.956 1.702 . . . . 20.0 113.44 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.08 26.01 65.23 Favored Glycine 0 CA--C 1.531 1.066 0 O-C-N 121.09 -1.006 . . . . 20.0 112.986 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.14 -115.05 4.2 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.078 1.323 . . . . 20.0 111.65 -174.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -75.0 -9.72 20.9 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.209 1.939 . . . . 20.0 113.345 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 t -62.2 -34.01 75.65 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.711 1.004 . . . . 20.0 113.711 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.0 m -78.37 0.14 26.81 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.007 1.114 . . . . 20.0 114.007 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.25 14.23 82.53 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 119.432 1.015 . . . . 20.0 114.939 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -98.43 123.31 50.81 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 126.143 1.777 . . . . 20.0 110.239 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.74 138.63 59.51 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.917 2.411 . . . . 20.0 112.553 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.47 136.3 49.9 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.718 2.279 . . . . 20.0 111.928 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 CA--C 1.539 0.74 0 C-N-CA 123.404 2.736 . . . . 20.0 110.933 177.66 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 112.523 0.564 . . . . 20.0 112.523 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -64.27 -34.61 78.51 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.597 0.759 . . . . 20.0 111.95 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.14 -46.18 72.18 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.135 0.42 . . . . 20.0 112.135 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -67.08 -42.37 84.78 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.511 0.596 . . . . 20.0 111.958 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -53.91 -47.69 70.92 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.79 0.436 . . . . 20.0 111.408 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.07 -41.78 97.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.929 0.714 . . . . 20.0 112.929 171.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -54.77 -42.62 71.93 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.514 1.126 . . . . 20.0 112.904 177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.27 -6.97 38.68 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.288 1.435 . . . . 20.0 113.822 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.7 2.89 37.25 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.499 1.523 . . . . 20.0 115.461 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 45.68 -109.39 0.32 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.566 2.031 . . . . 20.0 114.066 -178.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -54.88 -34.04 84.21 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.799 2.333 . . . . 20.0 113.681 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 m -66.6 -29.78 69.91 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.514 0.725 . . . . 20.0 112.819 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.27 -18.32 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.326 1.05 . . . . 20.0 112.704 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.93 5.69 53.37 Favored Glycine 0 CA--C 1.539 1.553 0 C-N-CA 124.755 1.169 . . . . 20.0 115.461 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -78.82 132.98 62.79 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.183 1.393 . . . . 20.0 110.548 178.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -41.94 121.65 1.85 Allowed 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.452 3.435 . . . . 20.0 114.183 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -67.32 128.58 18.62 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.321 2.681 . . . . 20.0 112.057 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo . . . . . 0 CA--C 1.54 0.799 0 C-N-CA 123.033 2.488 . . . . 20.0 111.024 176.359 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.251 0 N-CA-C 118.191 2.663 . . . . 20.0 118.191 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.71 -33.95 73.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.821 2.048 . . . . 20.0 114.117 -170.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.9 87.44 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.773 -0.579 . . . . 20.0 111.103 174.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.65 -45.13 88.06 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.554 0.741 . . . . 20.0 111.137 175.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.2 t90 -50.15 -48.8 53.65 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.807 0.843 . . . . 20.0 111.67 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.35 -54.44 43.71 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 118.487 -0.768 . . . . 20.0 112.099 171.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -52.49 -37.56 57.52 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.081 1.141 . . . . 20.0 114.081 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -71.66 -11.88 61.06 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.994 1.109 . . . . 20.0 113.994 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.98 22.31 3.93 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.683 1.135 . . . . 20.0 114.076 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.79 -129.66 45.2 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 118.227 1.013 . . . . 20.0 111.095 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.76 -15.58 37.15 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.469 2.113 . . . . 20.0 112.696 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 t -62.52 -15.39 50.23 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.488 0.921 . . . . 20.0 113.488 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -77.69 -10.42 59.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.482 1.513 . . . . 20.0 113.55 177.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.12 12.4 84.66 Favored Glycine 0 CA--C 1.538 1.474 0 CA-C-N 119.104 0.866 . . . . 20.0 114.922 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.17 126.48 29.59 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.869 1.668 . . . . 20.0 110.516 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -52.13 140.74 50.12 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.387 2.725 . . . . 20.0 113.282 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.81 126.75 17.22 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.437 2.758 . . . . 20.0 112.171 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo . . . . . 0 CA--C 1.548 1.179 0 C-N-CA 123.294 2.662 . . . . 20.0 111.889 177.539 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 113.334 0.864 . . . . 20.0 113.334 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -65.17 -38.82 91.77 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.627 0.771 . . . . 20.0 112.586 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.49 -44.54 85.03 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.802 0.728 . . . . 20.0 112.092 172.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.5 -43.0 77.78 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.967 -0.458 . . . . 20.0 111.67 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -51.88 -48.05 64.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.354 0.661 . . . . 20.0 111.348 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.02 -47.07 87.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 117.948 -1.025 . . . . 20.0 112.806 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -52.97 -40.8 64.0 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.704 1.138 . . . . 20.0 112.816 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -73.16 19.34 0.09 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 125.06 1.344 . . . . 20.0 113.616 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 26.13 47.96 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 126.562 2.03 . . . . 20.0 113.091 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.64 -115.97 4.36 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.77 1.176 . . . . 20.0 111.241 -170.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.75 -9.21 19.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.039 1.826 . . . . 20.0 113.504 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -59.8 -27.82 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.798 1.407 . . . . 20.0 114.798 -173.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -6.09 58.02 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.174 1.39 . . . . 20.0 113.165 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.01 -12.51 42.83 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.755 1.169 . . . . 20.0 115.511 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -58.98 119.42 37.79 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 125.589 1.556 . . . . 20.0 111.037 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.09 135.08 58.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.123 2.549 . . . . 20.0 112.783 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -63.51 139.26 69.46 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.545 2.163 . . . . 20.0 112.635 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo . . . . . 0 CA--C 1.538 0.713 0 C-N-CA 123.379 2.719 . . . . 20.0 111.056 176.12 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.789 0 N-CA-C 115.734 1.754 . . . . 20.0 115.734 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.66 -32.47 69.13 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.033 1.333 . . . . 20.0 113.359 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.13 -45.38 94.91 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.269 0.628 . . . . 20.0 111.06 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -68.61 -42.79 77.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.186 -0.435 . . . . 20.0 111.364 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -51.04 -49.84 59.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.329 0.652 . . . . 20.0 111.628 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.18 -47.74 84.68 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.97 0.73 . . . . 20.0 112.97 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.14 -38.67 65.73 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.152 0.887 . . . . 20.0 112.883 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -78.46 18.86 0.51 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.749 1.62 . . . . 20.0 113.549 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.12 23.61 37.33 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.589 1.566 . . . . 20.0 113.626 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.24 -116.93 7.49 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.861 1.22 . . . . 20.0 110.978 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.06 -9.89 20.88 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.106 1.871 . . . . 20.0 113.541 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 t -56.62 -36.64 69.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.536 1.062 . . . . 20.0 113.427 -175.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -8.01 52.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.384 1.473 . . . . 20.0 113.97 176.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.98 2.94 59.07 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.663 1.12 . . . . 20.0 115.248 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -74.11 133.82 78.08 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.029 1.332 . . . . 20.0 110.939 179.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -44.49 121.2 3.09 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.334 3.356 . . . . 20.0 113.634 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.53 118.38 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.229 2.619 . . . . 20.0 110.735 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 CA--C 1.537 0.668 0 C-N-CA 121.612 1.541 . . . . 20.0 110.511 173.655 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.404 0.891 . . . . 20.0 113.404 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -61.17 -39.89 91.84 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.709 1.204 . . . . 20.0 112.599 -172.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.83 78.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.885 0.874 . . . . 20.0 111.637 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -71.04 -41.83 70.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.161 0.584 . . . . 20.0 111.27 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.8 t90 -51.05 -48.59 61.51 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.836 0.854 . . . . 20.0 111.603 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.75 -43.21 94.39 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 118.723 -0.656 . . . . 20.0 112.65 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -57.18 -35.69 69.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.22 0.918 . . . . 20.0 113.366 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -73.42 13.31 0.47 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.304 1.224 . . . . 20.0 114.304 171.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 21.3 59.95 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.16 -1.587 . . . . 20.0 112.81 -175.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.3 -120.54 16.22 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.246 1.403 . . . . 20.0 111.805 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.7 -10.22 20.04 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.391 2.061 . . . . 20.0 113.208 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 t -72.94 -19.86 61.17 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.93 1.085 . . . . 20.0 113.93 -171.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.2 m -92.85 14.94 15.91 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.653 1.181 . . . . 20.0 113.969 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.48 14.36 74.67 Favored Glycine 0 CA--C 1.536 1.38 0 O-C-N 121.17 -0.956 . . . . 20.0 114.422 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -104.02 126.81 30.72 Favored Pre-proline 0 C--N 1.35 0.614 0 C-N-CA 125.099 1.36 . . . . 20.0 110.078 -171.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.0 144.5 47.59 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.241 1.961 . . . . 20.0 111.473 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.74 136.4 35.71 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.693 2.262 . . . . 20.0 111.779 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo . . . . . 0 CA--C 1.541 0.839 0 C-N-CA 123.767 2.978 . . . . 20.0 110.948 178.061 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.811 0 N-CA-C 113.218 0.822 . . . . 20.0 113.218 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -56.55 -42.1 77.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.33 1.452 . . . . 20.0 113.724 -174.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -48.82 74.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.054 0.942 . . . . 20.0 111.731 174.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.39 -43.47 81.27 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.661 0.384 . . . . 20.0 111.419 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -50.72 -50.48 55.17 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.958 0.903 . . . . 20.0 111.561 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.51 -44.46 97.04 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.638 0.607 . . . . 20.0 112.638 173.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -57.52 -34.92 69.6 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 20.0 113.572 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.82 -6.13 47.32 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 172.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.92 11.05 29.09 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.79 1.186 . . . . 20.0 114.224 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.68 -109.5 0.83 Allowed Glycine 0 CA--C 1.533 1.199 0 C-N-CA 126.523 2.011 . . . . 20.0 113.168 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -54.91 -31.66 74.44 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.713 2.275 . . . . 20.0 113.772 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -56.8 -38.07 72.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.163 0.985 . . . . 20.0 112.271 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -18.21 63.02 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.282 1.433 . . . . 20.0 113.635 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.99 3.73 12.09 Favored Glycine 0 CA--C 1.541 1.713 0 C-N-CA 124.945 1.259 . . . . 20.0 115.905 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 136.53 71.3 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.553 1.541 . . . . 20.0 110.003 177.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -45.36 120.91 3.44 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.177 3.251 . . . . 20.0 113.561 168.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.76 133.21 25.01 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.86 2.373 . . . . 20.0 111.943 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo . . . . . 0 CA--C 1.54 0.784 0 C-N-CA 123.351 2.7 . . . . 20.0 109.894 173.079 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 113.195 0.813 . . . . 20.0 113.195 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.71 -34.69 67.29 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.356 -0.84 . . . . 20.0 112.135 -170.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.57 70.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.43 0.692 . . . . 20.0 110.852 172.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -65.83 -41.26 92.01 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.825 0.85 . . . . 20.0 112.034 177.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -49.75 -51.47 38.78 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.399 0.545 . . . . 20.0 111.309 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.07 -50.37 72.23 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.853 -0.594 . . . . 20.0 112.063 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.8 tptp -56.34 -37.09 69.53 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.348 1.24 . . . . 20.0 114.348 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.32 -7.14 47.92 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.817 1.247 . . . . 20.0 114.357 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.49 23.02 4.57 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.419 1.009 . . . . 20.0 113.917 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.09 -127.74 43.95 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 118.197 0.999 . . . . 20.0 111.61 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.61 -14.69 36.93 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.077 2.518 . . . . 20.0 113.399 -174.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.6 m -70.44 -1.86 12.07 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.933 1.086 . . . . 20.0 113.933 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 m -91.63 6.04 47.33 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.998 1.719 . . . . 20.0 113.666 -170.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.9 12.99 79.07 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.552 1.072 . . . . 20.0 114.882 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -127.35 122.28 22.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.572 1.949 . . . . 20.0 110.679 -175.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.68 150.78 21.03 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.241 2.627 . . . . 20.0 113.784 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.22 115.06 2.76 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.083 3.189 . . . . 20.0 112.242 176.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo . . . . . 0 CA--C 1.54 0.82 0 C-N-CA 123.363 2.709 . . . . 20.0 110.839 179.73 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.826 0 N-CA-C 114.389 1.255 . . . . 20.0 114.389 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -57.91 -43.04 85.94 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.305 1.442 . . . . 20.0 113.62 -171.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.08 -45.03 79.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.834 0.853 . . . . 20.0 111.873 173.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -42.99 69.72 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.841 0.856 . . . . 20.0 111.661 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -51.07 -49.82 59.9 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.209 1.404 . . . . 20.0 111.645 174.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.93 -44.78 96.07 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.026 0.53 . . . . 20.0 112.138 173.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -56.08 -41.25 74.86 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.603 1.161 . . . . 20.0 112.943 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -69.7 -8.32 46.8 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.746 1.218 . . . . 20.0 113.949 174.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.04 8.21 39.54 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.897 1.237 . . . . 20.0 115.303 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 48.33 -110.0 0.6 Allowed Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.539 2.019 . . . . 20.0 113.814 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.74 -28.53 67.07 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.796 2.33 . . . . 20.0 114.029 176.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 t -69.77 -29.96 67.41 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.664 0.786 . . . . 20.0 112.942 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.73 -21.25 38.03 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.535 1.134 . . . . 20.0 112.622 -176.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.03 -14.43 20.65 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.856 1.693 . . . . 20.0 115.665 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 129.48 92.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 118.875 1.337 . . . . 20.0 111.029 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.54 135.17 60.7 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.08 2.52 . . . . 20.0 112.669 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.37 134.91 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.672 2.248 . . . . 20.0 112.291 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo . . . . . 0 CA--C 1.538 0.718 0 C-N-CA 123.603 2.869 . . . . 20.0 110.878 177.616 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.105 0 N-CA-C 116.27 1.952 . . . . 20.0 116.27 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -63.04 -36.79 84.75 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 113.823 1.045 . . . . 20.0 113.823 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.7 88.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.827 -0.546 . . . . 20.0 111.109 174.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -68.07 -42.39 80.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.003 0.521 . . . . 20.0 111.779 175.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -49.92 -47.79 52.1 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.237 0.615 . . . . 20.0 112.068 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.2 -44.89 94.08 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.318 0.858 . . . . 20.0 113.318 174.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -53.49 -39.45 64.56 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.372 1.069 . . . . 20.0 113.023 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.94 16.24 0.32 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 124.658 1.183 . . . . 20.0 114.037 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.63 27.98 40.65 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 120.027 -1.67 . . . . 20.0 112.662 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.4 -118.13 11.74 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.531 1.539 . . . . 20.0 111.985 -176.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -75.02 -7.07 18.82 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.392 2.061 . . . . 20.0 113.178 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -56.65 -34.84 67.73 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.701 1.2 . . . . 20.0 113.367 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.11 -8.35 37.47 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.612 1.565 . . . . 20.0 114.736 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.86 3.33 90.52 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-N 119.219 0.918 . . . . 20.0 114.437 -173.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -89.5 134.29 32.88 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 124.734 1.214 . . . . 20.0 110.477 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -72.3 152.81 55.95 Favored 'Trans proline' 0 CA--C 1.547 1.154 0 C-N-CA 122.097 1.865 . . . . 20.0 112.314 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.62 124.41 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.97 3.113 . . . . 20.0 111.99 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.542 0.885 0 C-N-CA 123.373 2.715 . . . . 20.0 112.085 -178.297 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 113.297 0.851 . . . . 20.0 113.297 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.33 -39.64 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.403 1.081 . . . . 20.0 111.771 -175.003 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.58 85.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.242 0.617 . . . . 20.0 111.836 173.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -44.83 86.47 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.291 0.636 . . . . 20.0 111.182 176.019 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -52.19 -46.91 65.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.024 0.529 . . . . 20.0 112.123 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -41.13 98.73 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.957 0.725 . . . . 20.0 112.957 174.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -39.66 66.97 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.133 0.973 . . . . 20.0 112.878 177.697 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -82.96 25.75 0.66 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.547 1.539 . . . . 20.0 113.988 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.71 27.31 59.12 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.938 1.256 . . . . 20.0 113.031 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.92 -115.39 6.41 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.22 1.39 . . . . 20.0 111.465 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -77.24 -5.96 16.12 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 122.292 1.994 . . . . 20.0 113.49 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.3 m -58.22 -34.06 70.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.63 1.172 . . . . 20.0 113.625 -173.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -5.03 44.74 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.403 1.881 . . . . 20.0 113.642 176.603 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.66 8.14 86.07 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.495 1.043 . . . . 20.0 114.913 -177.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -83.41 131.99 51.15 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.69 1.596 . . . . 20.0 110.471 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.09 140.18 48.83 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.005 1.804 . . . . 20.0 111.107 174.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.62 143.23 61.54 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.832 2.355 . . . . 20.0 111.942 178.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo . . . . . 0 CA--C 1.539 0.768 0 C-N-CA 123.344 2.696 . . . . 20.0 110.87 177.047 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.686 0 N-CA-C 112.826 0.676 . . . . 20.0 112.826 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -59.03 -35.36 73.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.608 0.763 . . . . 20.0 112.472 177.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.63 88.6 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.325 0.65 . . . . 20.0 111.734 176.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.85 -42.3 63.88 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.975 0.51 . . . . 20.0 111.195 175.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.7 t90 -54.5 -44.14 72.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.798 . . . . 20.0 112.103 177.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -62.02 -39.22 91.56 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.596 -0.69 . . . . 20.0 112.652 174.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -30.44 63.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.083 1.353 . . . . 20.0 112.323 176.677 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -85.73 18.57 2.82 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.688 1.195 . . . . 20.0 113.018 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.82 27.38 67.05 Favored Glycine 0 C--N 1.348 1.204 0 C-N-CA 125.796 1.665 . . . . 20.0 113.003 -173.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.81 -118.44 14.67 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.185 0.898 . . . . 20.0 111.462 -176.181 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -81.3 6.08 5.83 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.05 2.5 . . . . 20.0 113.677 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.3 p -68.87 -33.96 74.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.054 1.297 . . . . 20.0 113.468 -177.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -10.29 59.61 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.148 0.979 . . . . 20.0 113.031 177.285 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.09 16.26 79.04 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 123.771 0.7 . . . . 20.0 114.025 -176.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.16 133.58 31.5 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 125.338 1.455 . . . . 20.0 110.927 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.66 135.18 37.78 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.095 1.863 . . . . 20.0 111.392 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.0 136.44 65.51 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.61 2.874 . . . . 20.0 112.261 177.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo . . . . . 0 CA--C 1.539 0.735 0 C-N-CA 123.778 2.985 . . . . 20.0 111.39 -179.248 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 113.555 0.946 . . . . 20.0 113.555 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.83 -37.5 87.6 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.466 1.106 . . . . 20.0 113.18 -172.385 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.33 -47.04 82.58 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.352 0.661 . . . . 20.0 111.294 175.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -67.02 -42.31 85.14 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.648 0.779 . . . . 20.0 111.588 175.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -50.29 -50.84 49.25 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.864 0.866 . . . . 20.0 111.597 175.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.52 -45.19 94.72 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 119.154 -0.45 . . . . 20.0 112.163 173.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -54.09 -39.71 66.6 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.754 1.222 . . . . 20.0 113.095 178.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -75.39 12.64 0.92 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.547 1.539 . . . . 20.0 113.674 177.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.27 27.96 31.86 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 120.423 -1.423 . . . . 20.0 112.762 -176.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.19 -117.25 10.46 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.567 1.556 . . . . 20.0 111.882 -177.207 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.98 -7.4 19.15 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.404 2.069 . . . . 20.0 113.364 -179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.2 m -54.96 -34.24 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.772 1.229 . . . . 20.0 113.505 -174.64 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.02 -9.42 52.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.68 1.992 . . . . 20.0 114.474 176.248 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.14 8.96 87.01 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.086 0.857 . . . . 20.0 114.466 -174.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -92.35 131.23 35.04 Favored Pre-proline 0 CA--C 1.539 0.558 0 C-N-CA 125.017 1.327 . . . . 20.0 110.628 178.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -65.34 149.74 87.96 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 121.938 1.758 . . . . 20.0 112.176 174.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.45 128.34 16.17 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.827 3.018 . . . . 20.0 112.068 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo . . . . . 0 CA--C 1.54 0.815 0 C-N-CA 123.523 2.815 . . . . 20.0 111.185 -178.653 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.594 1.331 . . . . 20.0 114.594 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.37 -37.62 85.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.694 1.198 . . . . 20.0 113.438 -174.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.24 -44.75 88.41 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.314 0.646 . . . . 20.0 111.249 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -66.75 -41.31 88.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.006 0.522 . . . . 20.0 111.56 175.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 t90 -53.52 -49.45 67.56 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.215 0.461 . . . . 20.0 111.751 174.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.53 -40.95 98.43 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 118.585 -0.721 . . . . 20.0 112.923 174.421 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -53.55 -36.09 61.45 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.039 1.126 . . . . 20.0 114.039 176.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -79.77 10.83 3.66 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.728 1.211 . . . . 20.0 113.642 175.792 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.45 25.75 32.3 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 120.51 -1.369 . . . . 20.0 112.698 -176.319 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.39 -114.93 6.0 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.251 1.405 . . . . 20.0 111.772 -177.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.17 -6.51 15.76 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.261 1.974 . . . . 20.0 113.472 -179.553 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -56.59 -40.29 75.02 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.58 1.082 . . . . 20.0 113.478 -175.352 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -7.68 21.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 127.409 2.284 . . . . 20.0 114.909 174.364 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.26 10.94 84.41 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.714 1.143 . . . . 20.0 114.481 -175.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -90.44 134.34 31.25 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 125.322 1.449 . . . . 20.0 110.628 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.71 143.77 57.33 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.037 1.825 . . . . 20.0 111.582 178.143 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.04 141.72 49.0 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.05 2.5 . . . . 20.0 111.482 177.264 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 CA--C 1.538 0.686 0 C-N-CA 122.895 2.397 . . . . 20.0 111.003 177.166 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.658 1.355 . . . . 20.0 114.658 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.06 -37.63 85.71 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.001 1.32 . . . . 20.0 113.299 -172.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.18 88.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.352 0.661 . . . . 20.0 111.48 174.043 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -69.27 -42.32 75.69 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.457 0.703 . . . . 20.0 111.512 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -49.82 -51.64 38.29 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.868 0.867 . . . . 20.0 111.851 172.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.79 -46.02 90.5 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 118.822 -0.609 . . . . 20.0 112.545 173.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -52.68 -43.28 65.47 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.844 0.858 . . . . 20.0 113.075 175.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -71.25 17.03 0.08 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.298 1.439 . . . . 20.0 114.01 175.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.68 21.28 56.47 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 120.007 -1.683 . . . . 20.0 113.163 -178.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.99 -120.53 15.34 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.364 1.459 . . . . 20.0 111.706 -177.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.44 -9.13 21.36 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.351 2.034 . . . . 20.0 113.388 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 t -76.07 -12.69 60.17 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.442 1.275 . . . . 20.0 114.442 -171.987 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 m -95.3 15.74 18.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.41 1.084 . . . . 20.0 113.885 179.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.26 16.41 73.25 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.261 -0.9 . . . . 20.0 114.088 177.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -112.91 128.05 26.09 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 125.485 1.514 . . . . 20.0 110.429 -170.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.35 146.68 51.17 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.156 1.904 . . . . 20.0 111.696 -176.175 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.84 130.96 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.22 2.613 . . . . 20.0 112.091 178.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.536 0.624 0 C-N-CA 123.436 2.757 . . . . 20.0 110.379 178.011 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 114.142 1.164 . . . . 20.0 114.142 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.35 -35.37 71.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.99 0.916 . . . . 20.0 113.324 -176.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.26 -42.11 76.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.386 1.074 . . . . 20.0 112.223 173.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -73.54 -40.78 63.73 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.128 0.571 . . . . 20.0 111.126 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -53.93 -47.69 70.97 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.466 0.706 . . . . 20.0 112.242 175.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.73 -39.69 81.6 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.853 0.686 . . . . 20.0 112.853 174.585 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -34.08 69.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.038 1.335 . . . . 20.0 112.742 177.954 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -84.09 24.57 0.92 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.292 1.837 . . . . 20.0 113.241 174.237 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.06 24.63 76.22 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 120.931 -1.106 . . . . 20.0 112.848 -179.092 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.84 -112.7 2.98 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.458 1.504 . . . . 20.0 111.495 -174.543 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.85 -10.48 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.075 1.85 . . . . 20.0 113.255 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.1 t -58.09 -42.67 86.1 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.37 0.986 . . . . 20.0 113.372 -174.473 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.9 m -70.73 3.0 3.5 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.887 1.439 . . . . 20.0 114.887 174.539 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.0 9.61 85.28 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.188 1.358 . . . . 20.0 114.547 178.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -89.12 129.33 48.38 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.538 1.935 . . . . 20.0 109.974 -179.203 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.21 146.65 76.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.857 1.705 . . . . 20.0 111.201 176.302 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.46 134.03 31.97 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.922 2.414 . . . . 20.0 111.746 179.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 CA--C 1.539 0.755 0 C-N-CA 123.324 2.683 . . . . 20.0 110.871 176.632 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.94 0 N-CA-C 113.345 0.869 . . . . 20.0 113.345 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.01 -38.79 87.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.602 1.161 . . . . 20.0 113.075 -173.449 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.37 -33.01 73.89 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.793 0.837 . . . . 20.0 112.718 176.303 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -76.76 -43.69 35.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.633 0.773 . . . . 20.0 110.673 172.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -50.02 -50.44 47.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.379 0.672 . . . . 20.0 111.746 175.666 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.54 -39.04 89.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.092 0.775 . . . . 20.0 113.092 173.714 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.09 -41.46 78.93 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.608 1.163 . . . . 20.0 112.338 177.207 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -79.04 18.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.595 1.558 . . . . 20.0 114.151 176.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.76 22.11 54.11 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.825 1.202 . . . . 20.0 113.489 178.671 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.82 -116.25 8.73 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.525 1.059 . . . . 20.0 110.751 -175.359 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.69 -10.77 17.06 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.059 1.839 . . . . 20.0 113.646 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.4 m -58.74 -30.04 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.021 1.282 . . . . 20.0 114.196 -175.123 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.19 -3.46 39.69 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.302 1.441 . . . . 20.0 113.562 175.502 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.43 5.88 83.02 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 119.548 1.067 . . . . 20.0 114.489 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -83.09 130.82 55.76 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 126.759 2.023 . . . . 20.0 110.165 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.06 143.83 67.12 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.053 1.835 . . . . 20.0 111.397 174.692 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.95 134.76 33.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.023 2.482 . . . . 20.0 111.568 178.542 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo . . . . . 0 CA--C 1.536 0.615 0 C-N-CA 123.111 2.541 . . . . 20.0 110.826 177.339 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.23 0 N-CA-C 116.949 2.203 . . . . 20.0 116.949 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -61.21 -41.4 96.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.789 1.635 . . . . 20.0 113.674 -171.33 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.72 80.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.528 0.731 . . . . 20.0 111.739 174.607 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -68.67 -40.63 80.07 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.471 0.708 . . . . 20.0 111.478 177.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -53.7 -51.01 64.62 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.276 0.63 . . . . 20.0 111.969 171.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.97 -42.25 89.49 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.633 -0.667 . . . . 20.0 112.357 174.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -18.56 48.6 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.225 1.565 . . . . 20.0 115.225 177.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -95.89 20.1 10.46 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.302 2.241 . . . . 20.0 112.152 172.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.77 24.09 68.07 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 120.734 -1.229 . . . . 20.0 112.709 -177.187 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.51 -114.71 5.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.556 1.074 . . . . 20.0 111.279 -174.177 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -76.83 -9.67 18.23 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 121.935 1.757 . . . . 20.0 113.408 -178.128 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -32.8 70.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.499 1.296 . . . . 20.0 114.499 -175.361 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -79.12 11.03 3.01 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.998 1.11 . . . . 20.0 113.998 175.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.3 17.44 79.68 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.057 -1.027 . . . . 20.0 113.984 177.262 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -109.56 131.74 21.72 Favored Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 125.193 1.397 . . . . 20.0 110.238 -172.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -72.26 151.17 54.24 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.994 1.796 . . . . 20.0 111.833 -176.725 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.22 125.67 12.71 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.451 2.767 . . . . 20.0 111.638 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo . . . . . 0 CA--C 1.541 0.841 0 C-N-CA 123.288 2.658 . . . . 20.0 111.66 177.715 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.3 -40.71 94.17 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.553 0.741 . . . . 20.0 112.056 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -63.07 -38.48 91.35 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.0 0.818 . . . . 20.0 112.229 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.48 -48.63 74.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.213 0.605 . . . . 20.0 110.813 173.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -67.27 -42.65 83.51 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.253 0.621 . . . . 20.0 112.117 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 75.4 t90 -47.3 -50.31 21.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.155 1.382 . . . . 20.0 111.984 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.83 -46.23 85.99 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.301 -0.857 . . . . 20.0 112.521 173.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -54.25 -44.17 71.56 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.389 0.995 . . . . 20.0 113.107 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.2 -18.72 65.53 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.536 0.939 . . . . 20.0 113.536 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.52 9.16 10.47 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.869 1.223 . . . . 20.0 115.17 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.16 -112.44 1.3 Allowed Glycine 0 CA--C 1.535 1.315 0 C-N-CA 127.258 2.361 . . . . 20.0 113.695 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.18 -30.4 60.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.246 2.631 . . . . 20.0 113.88 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -60.26 -38.58 83.94 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.007 1.323 . . . . 20.0 111.847 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.42 -18.3 45.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 126.472 1.909 . . . . 20.0 113.229 -174.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.57 -13.64 1.58 Allowed Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.938 1.733 . . . . 20.0 116.368 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -54.66 126.52 57.3 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 119.077 1.438 . . . . 20.0 111.229 172.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -52.59 129.71 33.39 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.279 2.653 . . . . 20.0 112.809 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -64.84 140.09 65.37 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.289 1.993 . . . . 20.0 111.941 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.17 114.91 3.87 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.244 2.629 . . . . 20.0 110.75 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 39.9 m . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.11 -1.424 . . . . 20.0 111.823 169.141 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 119.098 -0.477 . . . . 20.0 111.162 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.58 -32.0 71.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.463 0.542 . . . . 20.0 112.463 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -63.7 -37.27 86.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.256 0.622 . . . . 20.0 112.158 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.89 79.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.718 0.807 . . . . 20.0 111.032 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -69.75 -38.69 76.89 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.348 0.499 . . . . 20.0 112.348 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 t90 -51.17 -52.59 42.73 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.213 1.005 . . . . 20.0 111.451 174.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.4 -44.42 96.48 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.693 0.627 . . . . 20.0 112.693 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.45 57.79 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.517 1.303 . . . . 20.0 114.517 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.66 15.81 19.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.154 0.982 . . . . 20.0 112.941 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.12 20.98 37.01 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.494 1.045 . . . . 20.0 112.96 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.15 -114.36 3.64 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.197 1.855 . . . . 20.0 111.495 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -52.65 -28.78 38.65 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.092 3.195 . . . . 20.0 114.205 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -54.43 -29.28 48.84 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.079 1.351 . . . . 20.0 112.47 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -20.62 62.95 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.938 1.695 . . . . 20.0 113.55 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.17 17.12 65.49 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 124.703 1.145 . . . . 20.0 115.734 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 139.02 21.22 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 125.36 1.464 . . . . 20.0 111.167 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -52.55 129.38 31.84 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 123.732 2.955 . . . . 20.0 113.124 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -67.23 133.82 31.81 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.721 2.281 . . . . 20.0 111.912 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -77.4 81.98 2.5 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.797 2.998 . . . . 20.0 111.348 -178.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.249 1.052 0 CA-C-O 116.726 -1.606 . . . . 20.0 111.989 170.449 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 112.921 0.712 . . . . 20.0 112.921 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.12 14.72 23.77 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.284 1.433 . . . . 20.0 112.576 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -64.97 -38.83 92.26 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.74 1.616 . . . . 20.0 112.503 -176.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.75 -48.16 72.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.763 0.825 . . . . 20.0 111.013 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.32 -43.09 87.17 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.181 0.592 . . . . 20.0 111.68 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 49.4 t90 -53.28 -47.55 69.07 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.045 0.938 . . . . 20.0 112.041 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.99 -46.66 89.85 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 119.111 -0.471 . . . . 20.0 111.746 171.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.814 1.246 . . . . 20.0 113.899 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -67.69 -17.92 64.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.883 1.273 . . . . 20.0 113.632 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.85 21.37 4.25 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.345 1.45 . . . . 20.0 114.818 -178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.99 -129.22 38.05 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.548 1.174 . . . . 20.0 111.151 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.42 -10.33 22.13 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 121.952 1.768 . . . . 20.0 113.07 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -59.68 -34.64 73.12 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.868 1.267 . . . . 20.0 112.994 -173.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.87 -4.51 38.32 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.015 1.726 . . . . 20.0 113.531 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.95 9.89 86.61 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 124.085 0.85 . . . . 20.0 114.795 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -94.55 133.3 27.11 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 125.379 1.472 . . . . 20.0 110.581 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.92 144.71 65.54 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.041 1.828 . . . . 20.0 111.55 176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.59 136.81 40.54 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.884 2.389 . . . . 20.0 111.302 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.32 136.31 15.81 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.923 2.415 . . . . 20.0 110.647 175.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.253 1.256 0 C-N-CA 128.119 2.568 . . . . 20.0 108.814 176.215 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 16.3 t0 . . . . . 0 N--CA 1.474 0.764 0 CA-C-O 120.702 0.286 . . . . 20.0 110.61 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.64 -36.74 0.14 Allowed 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.299 0.852 . . . . 20.0 113.299 -177.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.58 -33.63 70.18 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.848 0.859 . . . . 20.0 112.853 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.34 -48.56 74.01 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.285 1.034 . . . . 20.0 111.803 171.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -67.46 -43.43 81.06 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.836 0.455 . . . . 20.0 110.838 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -47.9 -50.55 26.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.231 1.012 . . . . 20.0 112.029 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.61 -40.54 92.75 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.192 0.812 . . . . 20.0 113.192 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -32.39 66.96 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.446 1.276 . . . . 20.0 114.446 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -77.78 -12.8 60.01 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.502 0.927 . . . . 20.0 113.502 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.24 7.7 34.7 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.348 1.451 . . . . 20.0 114.382 -175.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.85 -113.71 5.31 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.143 -1.365 . . . . 20.0 112.528 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.51 -29.65 60.75 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.38 2.72 . . . . 20.0 114.817 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.9 p -56.39 -39.41 72.92 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.972 0.909 . . . . 20.0 112.887 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -82.8 -16.39 47.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.998 1.319 . . . . 20.0 113.052 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.01 -7.57 3.06 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.379 1.466 . . . . 20.0 116.238 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.48 125.08 51.25 Favored Pre-proline 0 CA--C 1.545 0.769 0 CA-C-N 119.195 1.497 . . . . 20.0 110.942 174.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.38 128.43 27.67 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.254 2.636 . . . . 20.0 112.961 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 136.01 42.69 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.383 2.056 . . . . 20.0 111.486 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.46 124.58 9.98 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.789 2.326 . . . . 20.0 109.569 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.1 m . . . . . 0 C--O 1.251 1.153 0 C-N-CA 126.125 1.77 . . . . 20.0 109.712 176.835 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 118.464 -0.779 . . . . 20.0 111.468 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 59.0 2.01 0.23 Allowed 'General case' 0 CA--C 1.554 1.1 0 N-CA-C 117.379 2.363 . . . . 20.0 117.379 178.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.07 -38.12 75.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.277 1.431 . . . . 20.0 113.539 -175.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.96 81.64 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.544 -0.723 . . . . 20.0 111.479 174.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -65.8 -42.71 90.38 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.522 0.729 . . . . 20.0 111.241 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -49.67 -52.14 33.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.161 0.584 . . . . 20.0 111.381 174.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.98 -45.29 94.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.64 0.776 . . . . 20.0 112.796 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -52.56 -41.41 63.53 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.241 1.416 . . . . 20.0 113.184 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.78 8.31 3.82 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.734 1.614 . . . . 20.0 114.183 176.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.31 18.1 53.81 Favored Glycine 0 CA--C 1.532 1.129 0 O-C-N 120.631 -1.293 . . . . 20.0 113.532 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.95 -113.58 3.35 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.377 1.942 . . . . 20.0 112.472 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -53.32 -28.43 43.2 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.284 2.656 . . . . 20.0 113.61 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -55.33 -38.14 68.34 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.951 1.3 . . . . 20.0 112.152 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.7 p -72.44 -9.59 58.73 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 115.324 1.601 . . . . 20.0 115.324 174.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.59 17.43 62.34 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 119.997 1.272 . . . . 20.0 115.569 175.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -106.82 135.24 19.57 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 125.412 1.485 . . . . 20.0 111.316 -176.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.28 125.92 18.98 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.727 2.952 . . . . 20.0 113.281 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.14 135.21 39.49 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.492 2.128 . . . . 20.0 112.309 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.72 98.65 1.16 Allowed 'Trans proline' 0 CA--C 1.537 0.625 0 C-N-CA 123.738 2.958 . . . . 20.0 111.254 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.862 -1.542 . . . . 20.0 111.225 174.171 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 118.08 -0.962 . . . . 20.0 110.841 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -52.88 -32.4 44.85 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.032 1.493 . . . . 20.0 115.032 -171.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -60.38 -32.09 70.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.524 1.13 . . . . 20.0 113.266 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.5 98.76 Favored 'General case' 0 CA--C 1.537 0.442 0 O-C-N 121.891 -0.505 . . . . 20.0 110.683 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -41.9 75.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.248 1.019 . . . . 20.0 111.383 175.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.2 t90 -51.86 -51.14 58.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.633 0.773 . . . . 20.0 112.244 175.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.48 -36.48 82.63 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.943 0.72 . . . . 20.0 112.943 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.3 tttp -60.21 -33.32 72.09 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.683 1.193 . . . . 20.0 113.582 -177.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -83.24 3.68 30.15 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.983 1.313 . . . . 20.0 113.447 173.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.48 16.27 34.97 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 120.95 -1.094 . . . . 20.0 114.023 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.14 -107.02 0.84 Allowed Glycine 0 CA--C 1.533 1.194 0 C-N-CA 126.852 2.168 . . . . 20.0 113.277 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -55.66 -30.04 73.48 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.535 2.157 . . . . 20.0 113.508 172.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -57.35 -36.01 70.66 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.082 1.353 . . . . 20.0 112.473 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.52 -15.85 61.78 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.931 1.692 . . . . 20.0 113.245 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.88 4.14 13.35 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.129 1.347 . . . . 20.0 115.744 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -79.88 136.03 55.0 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 125.672 1.589 . . . . 20.0 110.571 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_exo -44.71 121.21 3.22 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.193 3.262 . . . . 20.0 113.564 173.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.61 124.73 12.78 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.927 2.418 . . . . 20.0 110.589 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.9 156.39 48.01 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 121.887 1.725 . . . . 20.0 110.879 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.9 p . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.153 1.781 . . . . 20.0 111.288 177.015 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 114.313 1.227 . . . . 20.0 114.313 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.0 -31.68 69.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.081 -1.637 . . . . 20.0 113.97 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.29 -32.84 74.36 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.649 0.779 . . . . 20.0 112.623 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.2 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.676 0.791 . . . . 20.0 111.386 173.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -66.59 -45.57 78.81 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.562 -0.732 . . . . 20.0 110.946 175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -48.55 -49.29 36.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.531 0.732 . . . . 20.0 112.63 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.32 -46.54 85.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.006 0.522 . . . . 20.0 112.398 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -55.53 -32.21 62.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.627 1.171 . . . . 20.0 113.637 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -82.16 17.46 1.63 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.168 1.387 . . . . 20.0 114.252 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.61 27.9 37.37 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.331 1.443 . . . . 20.0 112.846 -177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -115.21 4.78 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.263 1.411 . . . . 20.0 111.697 -172.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.93 -8.61 17.9 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.239 1.959 . . . . 20.0 113.519 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.9 m -55.99 -36.45 67.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.899 1.279 . . . . 20.0 113.764 -171.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.07 -4.31 54.82 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.872 2.069 . . . . 20.0 113.514 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.97 -10.83 31.3 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.237 1.399 . . . . 20.0 115.421 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.79 117.65 22.64 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.196 1.799 . . . . 20.0 111.081 172.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.28 137.02 76.06 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 122.973 2.449 . . . . 20.0 112.969 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -66.36 134.31 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.861 2.374 . . . . 20.0 112.6 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.04 103.16 1.44 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.325 2.683 . . . . 20.0 110.142 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.495 1.918 . . . . 20.0 110.513 179.519 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 114.064 1.135 . . . . 20.0 114.064 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.7 -32.36 70.44 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 119.968 -1.707 . . . . 20.0 114.426 -176.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -63.93 -36.62 84.56 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.228 1.011 . . . . 20.0 112.273 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.62 82.46 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 122.969 0.508 . . . . 20.0 110.495 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -67.05 -38.82 86.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.452 0.538 . . . . 20.0 112.452 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.44 ' CD1' ' HD2' ' A' ' 16' ' ' ARG . 68.2 t90 -52.12 -51.55 57.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.886 0.875 . . . . 20.0 111.152 174.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.41 -45.32 94.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 119.094 -0.479 . . . . 20.0 112.159 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -55.39 -38.73 69.25 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.092 1.145 . . . . 20.0 114.092 -178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.0 5.7 4.03 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.356 1.243 . . . . 20.0 114.356 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.59 37.35 Favored Glycine 0 CA--C 1.531 1.084 0 O-C-N 120.616 -1.303 . . . . 20.0 112.913 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.99 -113.16 3.37 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.38 1.943 . . . . 20.0 112.523 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.78 -28.24 56.6 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.494 2.796 . . . . 20.0 114.131 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.5 m -52.47 -37.81 57.95 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 20.0 112.194 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -24.03 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.412 2.285 . . . . 20.0 114.578 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.61 1.66 Allowed Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.505 1.526 . . . . 20.0 116.884 -172.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD2' ' CD1' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -64.45 132.34 95.34 Favored Pre-proline 0 N--CA 1.476 0.838 0 CA-C-N 119.956 1.878 . . . . 20.0 111.281 174.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.5 126.81 18.8 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.503 2.802 . . . . 20.0 112.319 171.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -64.36 138.53 61.0 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.191 1.928 . . . . 20.0 111.501 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.19 150.98 48.58 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.305 2.003 . . . . 20.0 110.764 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t . . . . . 0 C--O 1.253 1.253 0 C-N-CA 125.29 1.436 . . . . 20.0 110.915 174.8 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.2 t70 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 108.634 -0.876 . . . . 20.0 108.634 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.67 -33.81 0.38 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.861 0.864 . . . . 20.0 112.92 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.34 -34.98 71.22 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.881 0.872 . . . . 20.0 112.821 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.73 -50.3 72.64 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 20.0 111.032 174.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -70.26 -33.84 72.08 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.545 0.738 . . . . 20.0 112.389 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.3 t90 -52.19 -55.19 22.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.767 0.827 . . . . 20.0 110.746 172.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.01 -47.15 87.78 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.829 -0.605 . . . . 20.0 112.331 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -39.53 70.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.549 0.74 . . . . 20.0 112.822 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -85.58 32.05 0.58 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.051 1.74 . . . . 20.0 112.379 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.73 27.29 54.4 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.396 0.998 . . . . 20.0 114.138 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.89 -116.92 8.92 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 118.087 0.943 . . . . 20.0 111.498 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.53 -14.95 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.062 1.842 . . . . 20.0 113.534 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -61.29 -23.64 65.84 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.284 1.216 . . . . 20.0 114.284 -174.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -3.23 33.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.733 1.213 . . . . 20.0 113.894 175.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.72 8.38 87.74 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.727 1.149 . . . . 20.0 114.87 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -97.65 127.35 37.89 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 125.664 1.586 . . . . 20.0 110.59 176.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -52.15 140.04 51.69 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.672 2.248 . . . . 20.0 112.377 172.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.52 130.4 28.12 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 122.634 2.223 . . . . 20.0 111.196 175.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -73.2 156.92 50.92 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.175 1.917 . . . . 20.0 110.799 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 C--O 1.248 0.996 0 C-N-CA 126.033 1.733 . . . . 20.0 109.634 -177.305 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 112.844 0.683 . . . . 20.0 112.844 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.36 -26.86 68.66 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.262 1.025 . . . . 20.0 113.134 175.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.6 -34.91 73.35 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.91 0.884 . . . . 20.0 112.454 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.73 -31.31 72.21 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.8 0.84 . . . . 20.0 112.636 175.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -43.11 20.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.955 0.902 . . . . 20.0 110.571 171.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -48.0 -52.54 19.51 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.513 1.125 . . . . 20.0 112.316 176.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.4 mt -60.73 -39.05 87.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -59.17 -41.49 88.53 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.926 1.69 . . . . 20.0 111.954 178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -76.01 28.66 0.11 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 126.683 1.993 . . . . 20.0 114.15 172.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.18 28.28 66.61 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 125.155 1.359 . . . . 20.0 113.698 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.76 -117.09 6.75 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.97 1.271 . . . . 20.0 111.56 -173.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -75.82 -10.81 20.01 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.04 1.827 . . . . 20.0 113.396 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -54.8 -39.58 68.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.308 1.043 . . . . 20.0 113.252 -173.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.7 m -75.81 -8.9 57.99 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.584 1.327 . . . . 20.0 114.584 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.01 -10.72 46.25 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 115.973 1.149 . . . . 20.0 115.973 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -58.7 122.84 64.31 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 118.93 1.365 . . . . 20.0 111.127 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -54.19 136.38 67.85 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.003 2.469 . . . . 20.0 112.931 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.64 130.26 24.45 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.783 2.322 . . . . 20.0 111.752 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -73.03 124.6 9.71 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.727 2.284 . . . . 20.0 109.766 176.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 p . . . . . 0 C--O 1.252 1.231 0 CA-C-O 116.862 -1.542 . . . . 20.0 110.41 175.404 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 N--CA 1.488 1.475 0 N-CA-C 114.741 1.386 . . . . 20.0 114.741 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.44 10.02 13.46 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.54 -1.35 . . . . 20.0 114.194 -174.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.14 -37.63 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.5 1.12 . . . . 20.0 113.458 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.33 -45.44 91.34 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.635 -0.665 . . . . 20.0 111.372 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -66.92 -35.22 79.5 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.408 0.683 . . . . 20.0 111.836 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.7 t90 -58.26 -52.08 67.07 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.191 -0.943 . . . . 20.0 111.268 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -59.14 -44.62 92.06 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.371 0.668 . . . . 20.0 112.657 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -38.06 53.66 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.52 1.128 . . . . 20.0 113.596 176.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -83.63 26.49 0.68 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.956 1.702 . . . . 20.0 113.44 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.08 26.01 65.23 Favored Glycine 0 CA--C 1.531 1.066 0 O-C-N 121.09 -1.006 . . . . 20.0 112.986 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.14 -115.05 4.2 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.078 1.323 . . . . 20.0 111.65 -174.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -75.0 -9.72 20.9 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.209 1.939 . . . . 20.0 113.345 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 t -62.2 -34.01 75.65 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.711 1.004 . . . . 20.0 113.711 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.0 m -78.37 0.14 26.81 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.007 1.114 . . . . 20.0 114.007 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.25 14.23 82.53 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 119.432 1.015 . . . . 20.0 114.939 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -98.43 123.31 50.81 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 126.143 1.777 . . . . 20.0 110.239 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.74 138.63 59.51 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.917 2.411 . . . . 20.0 112.553 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.47 136.3 49.9 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.718 2.279 . . . . 20.0 111.928 177.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -79.13 115.59 3.53 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.404 2.736 . . . . 20.0 110.933 177.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.5 m . . . . . 0 C--O 1.251 1.145 0 C-N-CA 125.601 1.56 . . . . 20.0 110.996 169.079 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.8 t0 . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 109.305 -0.628 . . . . 20.0 109.305 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.17 -30.74 9.04 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.685 0.794 . . . . 20.0 112.523 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -64.27 -34.61 78.51 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.597 0.759 . . . . 20.0 111.95 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.14 -46.18 72.18 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.135 0.42 . . . . 20.0 112.135 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -67.08 -42.37 84.78 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.511 0.596 . . . . 20.0 111.958 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -53.91 -47.69 70.92 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.79 0.436 . . . . 20.0 111.408 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.07 -41.78 97.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.929 0.714 . . . . 20.0 112.929 171.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -54.77 -42.62 71.93 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.514 1.126 . . . . 20.0 112.904 177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.27 -6.97 38.68 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.288 1.435 . . . . 20.0 113.822 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.7 2.89 37.25 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.499 1.523 . . . . 20.0 115.461 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 45.68 -109.39 0.32 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.566 2.031 . . . . 20.0 114.066 -178.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -54.88 -34.04 84.21 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.799 2.333 . . . . 20.0 113.681 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 m -66.6 -29.78 69.91 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.514 0.725 . . . . 20.0 112.819 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.27 -18.32 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.326 1.05 . . . . 20.0 112.704 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 69.93 5.69 53.37 Favored Glycine 0 CA--C 1.539 1.553 0 C-N-CA 124.755 1.169 . . . . 20.0 115.461 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -78.82 132.98 62.79 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.183 1.393 . . . . 20.0 110.548 178.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -41.94 121.65 1.85 Allowed 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.452 3.435 . . . . 20.0 114.183 172.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -67.32 128.58 18.62 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.321 2.681 . . . . 20.0 112.057 178.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.23 89.3 1.33 Allowed 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.033 2.488 . . . . 20.0 111.024 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p . . . . . 0 C--O 1.258 1.521 0 CA-C-O 114.656 -2.593 . . . . 20.0 110.96 176.85 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.6 t70 . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 117.557 -1.211 . . . . 20.0 108.78 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 51.4 -6.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 118.191 2.663 . . . . 20.0 118.191 -176.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.71 -33.95 73.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.821 2.048 . . . . 20.0 114.117 -170.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.9 87.44 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.773 -0.579 . . . . 20.0 111.103 174.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.65 -45.13 88.06 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.554 0.741 . . . . 20.0 111.137 175.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.2 t90 -50.15 -48.8 53.65 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.807 0.843 . . . . 20.0 111.67 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.35 -54.44 43.71 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 118.487 -0.768 . . . . 20.0 112.099 171.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -52.49 -37.56 57.52 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.081 1.141 . . . . 20.0 114.081 -178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -71.66 -11.88 61.06 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.994 1.109 . . . . 20.0 113.994 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.98 22.31 3.93 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.683 1.135 . . . . 20.0 114.076 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.79 -129.66 45.2 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 118.227 1.013 . . . . 20.0 111.095 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.76 -15.58 37.15 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.469 2.113 . . . . 20.0 112.696 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 t -62.52 -15.39 50.23 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.488 0.921 . . . . 20.0 113.488 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -77.69 -10.42 59.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.482 1.513 . . . . 20.0 113.55 177.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.12 12.4 84.66 Favored Glycine 0 CA--C 1.538 1.474 0 CA-C-N 119.104 0.866 . . . . 20.0 114.922 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.17 126.48 29.59 Favored Pre-proline 0 N--CA 1.473 0.689 0 C-N-CA 125.869 1.668 . . . . 20.0 110.516 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -52.13 140.74 50.12 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.387 2.725 . . . . 20.0 113.282 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.81 126.75 17.22 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.437 2.758 . . . . 20.0 112.171 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.7 64.08 8.81 Favored 'Trans proline' 0 CA--C 1.548 1.179 0 C-N-CA 123.294 2.662 . . . . 20.0 111.889 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 C--O 1.248 1.002 0 C-N-CA 127.209 2.204 . . . . 20.0 110.995 173.345 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 109.802 -0.444 . . . . 20.0 109.802 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.7 -17.08 14.04 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.883 0.873 . . . . 20.0 113.334 172.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -65.17 -38.82 91.77 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.627 0.771 . . . . 20.0 112.586 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.49 -44.54 85.03 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.802 0.728 . . . . 20.0 112.092 172.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.5 -43.0 77.78 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.967 -0.458 . . . . 20.0 111.67 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -51.88 -48.05 64.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.354 0.661 . . . . 20.0 111.348 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.02 -47.07 87.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 117.948 -1.025 . . . . 20.0 112.806 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -52.97 -40.8 64.0 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.704 1.138 . . . . 20.0 112.816 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -73.16 19.34 0.09 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 125.06 1.344 . . . . 20.0 113.616 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 26.13 47.96 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 126.562 2.03 . . . . 20.0 113.091 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.64 -115.97 4.36 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.77 1.176 . . . . 20.0 111.241 -170.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.75 -9.21 19.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.039 1.826 . . . . 20.0 113.504 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -59.8 -27.82 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.798 1.407 . . . . 20.0 114.798 -173.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.21 -6.09 58.02 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.174 1.39 . . . . 20.0 113.165 179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.01 -12.51 42.83 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.755 1.169 . . . . 20.0 115.511 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -58.98 119.42 37.79 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 125.589 1.556 . . . . 20.0 111.037 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.09 135.08 58.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.123 2.549 . . . . 20.0 112.783 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -63.51 139.26 69.46 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.545 2.163 . . . . 20.0 112.635 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.72 107.5 2.38 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.379 2.719 . . . . 20.0 111.056 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 C--O 1.247 0.94 0 C-N-CA 125.745 1.618 . . . . 20.0 110.821 176.321 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 118.583 -0.722 . . . . 20.0 111.746 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.18 -27.38 3.54 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 115.734 1.754 . . . . 20.0 115.734 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.66 -32.47 69.13 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.033 1.333 . . . . 20.0 113.359 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.13 -45.38 94.91 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.269 0.628 . . . . 20.0 111.06 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -68.61 -42.79 77.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.186 -0.435 . . . . 20.0 111.364 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -51.04 -49.84 59.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.329 0.652 . . . . 20.0 111.628 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.18 -47.74 84.68 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.97 0.73 . . . . 20.0 112.97 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.14 -38.67 65.73 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.152 0.887 . . . . 20.0 112.883 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -78.46 18.86 0.51 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.749 1.62 . . . . 20.0 113.549 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.12 23.61 37.33 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.589 1.566 . . . . 20.0 113.626 178.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.24 -116.93 7.49 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.861 1.22 . . . . 20.0 110.978 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.06 -9.89 20.88 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.106 1.871 . . . . 20.0 113.541 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 t -56.62 -36.64 69.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.536 1.062 . . . . 20.0 113.427 -175.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -8.01 52.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.384 1.473 . . . . 20.0 113.97 176.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.98 2.94 59.07 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.663 1.12 . . . . 20.0 115.248 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -74.11 133.82 78.08 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.029 1.332 . . . . 20.0 110.939 179.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -44.49 121.2 3.09 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.334 3.356 . . . . 20.0 113.634 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.53 118.38 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.229 2.619 . . . . 20.0 110.735 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.3 150.61 47.38 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 121.612 1.541 . . . . 20.0 110.511 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.252 1.219 0 C-N-CA 126.024 1.73 . . . . 20.0 109.459 174.816 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 108.811 -0.811 . . . . 20.0 108.811 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.58 7.6 2.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.467 1.107 . . . . 20.0 113.404 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -61.17 -39.89 91.84 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.709 1.204 . . . . 20.0 112.599 -172.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.83 78.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.885 0.874 . . . . 20.0 111.637 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -71.04 -41.83 70.3 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.161 0.584 . . . . 20.0 111.27 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.8 t90 -51.05 -48.59 61.51 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.836 0.854 . . . . 20.0 111.603 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.75 -43.21 94.39 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 118.723 -0.656 . . . . 20.0 112.65 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -57.18 -35.69 69.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.22 0.918 . . . . 20.0 113.366 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -73.42 13.31 0.47 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.304 1.224 . . . . 20.0 114.304 171.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 21.3 59.95 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.16 -1.587 . . . . 20.0 112.81 -175.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.3 -120.54 16.22 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.246 1.403 . . . . 20.0 111.805 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.7 -10.22 20.04 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.391 2.061 . . . . 20.0 113.208 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 t -72.94 -19.86 61.17 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.93 1.085 . . . . 20.0 113.93 -171.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.2 m -92.85 14.94 15.91 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.653 1.181 . . . . 20.0 113.969 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.48 14.36 74.67 Favored Glycine 0 CA--C 1.536 1.38 0 O-C-N 121.17 -0.956 . . . . 20.0 114.422 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -104.02 126.81 30.72 Favored Pre-proline 0 C--N 1.35 0.614 0 C-N-CA 125.099 1.36 . . . . 20.0 110.078 -171.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.0 144.5 47.59 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.241 1.961 . . . . 20.0 111.473 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.74 136.4 35.71 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.693 2.262 . . . . 20.0 111.779 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -79.9 72.37 6.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.767 2.978 . . . . 20.0 110.948 178.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 116.791 -1.576 . . . . 20.0 111.272 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 112.534 0.568 . . . . 20.0 112.534 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.65 1.15 55.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.657 1.183 . . . . 20.0 113.218 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -56.55 -42.1 77.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.33 1.452 . . . . 20.0 113.724 -174.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.91 -48.82 74.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.054 0.942 . . . . 20.0 111.731 174.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.39 -43.47 81.27 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.661 0.384 . . . . 20.0 111.419 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -50.72 -50.48 55.17 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.958 0.903 . . . . 20.0 111.561 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.51 -44.46 97.04 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.638 0.607 . . . . 20.0 112.638 173.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -57.52 -34.92 69.6 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 20.0 113.572 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.82 -6.13 47.32 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 172.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.92 11.05 29.09 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.79 1.186 . . . . 20.0 114.224 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 51.68 -109.5 0.83 Allowed Glycine 0 CA--C 1.533 1.199 0 C-N-CA 126.523 2.011 . . . . 20.0 113.168 177.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -54.91 -31.66 74.44 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.713 2.275 . . . . 20.0 113.772 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -56.8 -38.07 72.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.163 0.985 . . . . 20.0 112.271 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -18.21 63.02 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.282 1.433 . . . . 20.0 113.635 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.99 3.73 12.09 Favored Glycine 0 CA--C 1.541 1.713 0 C-N-CA 124.945 1.259 . . . . 20.0 115.905 -176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 136.53 71.3 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.553 1.541 . . . . 20.0 110.003 177.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -45.36 120.91 3.44 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.177 3.251 . . . . 20.0 113.561 168.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.76 133.21 25.01 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.86 2.373 . . . . 20.0 111.943 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -78.27 80.34 3.04 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.351 2.7 . . . . 20.0 109.894 173.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.257 1.478 0 CA-C-O 112.894 -3.431 . . . . 20.0 114.437 176.501 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 21.2 t0 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.699 -0.852 . . . . 20.0 108.699 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.53 7.18 1.7 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.82 1.248 . . . . 20.0 113.195 173.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.71 -34.69 67.29 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.356 -0.84 . . . . 20.0 112.135 -170.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.57 70.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.43 0.692 . . . . 20.0 110.852 172.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -65.83 -41.26 92.01 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.825 0.85 . . . . 20.0 112.034 177.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -49.75 -51.47 38.78 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.399 0.545 . . . . 20.0 111.309 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.07 -50.37 72.23 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 118.853 -0.594 . . . . 20.0 112.063 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.8 tptp -56.34 -37.09 69.53 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.348 1.24 . . . . 20.0 114.348 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.32 -7.14 47.92 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.817 1.247 . . . . 20.0 114.357 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.49 23.02 4.57 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.419 1.009 . . . . 20.0 113.917 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.09 -127.74 43.95 Favored Glycine 0 CA--C 1.539 1.565 0 CA-C-N 118.197 0.999 . . . . 20.0 111.61 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.61 -14.69 36.93 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.077 2.518 . . . . 20.0 113.399 -174.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.6 m -70.44 -1.86 12.07 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.933 1.086 . . . . 20.0 113.933 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 m -91.63 6.04 47.33 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.998 1.719 . . . . 20.0 113.666 -170.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.9 12.99 79.07 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.552 1.072 . . . . 20.0 114.882 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -127.35 122.28 22.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.572 1.949 . . . . 20.0 110.679 -175.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -52.68 150.78 21.03 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.241 2.627 . . . . 20.0 113.784 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.22 115.06 2.76 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.083 3.189 . . . . 20.0 112.242 176.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -79.31 65.93 8.82 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.363 2.709 . . . . 20.0 110.839 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.1 t . . . . . 0 C--O 1.257 1.448 0 CA-C-O 112.627 -3.558 . . . . 20.0 114.999 -179.65 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 CA-C-O 118.413 -0.803 . . . . 20.0 112.509 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.75 13.6 12.06 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.389 1.255 . . . . 20.0 114.389 -168.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -57.91 -43.04 85.94 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.305 1.442 . . . . 20.0 113.62 -171.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.08 -45.03 79.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.834 0.853 . . . . 20.0 111.873 173.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.76 -42.99 69.72 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.841 0.856 . . . . 20.0 111.661 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -51.07 -49.82 59.9 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.209 1.404 . . . . 20.0 111.645 174.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.93 -44.78 96.07 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.026 0.53 . . . . 20.0 112.138 173.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -56.08 -41.25 74.86 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.603 1.161 . . . . 20.0 112.943 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -69.7 -8.32 46.8 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.746 1.218 . . . . 20.0 113.949 174.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.04 8.21 39.54 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.897 1.237 . . . . 20.0 115.303 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 48.33 -110.0 0.6 Allowed Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.539 2.019 . . . . 20.0 113.814 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.74 -28.53 67.07 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.796 2.33 . . . . 20.0 114.029 176.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 t -69.77 -29.96 67.41 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.664 0.786 . . . . 20.0 112.942 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.73 -21.25 38.03 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.535 1.134 . . . . 20.0 112.622 -176.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.03 -14.43 20.65 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.856 1.693 . . . . 20.0 115.665 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.05 129.48 92.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 118.875 1.337 . . . . 20.0 111.029 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.54 135.17 60.7 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.08 2.52 . . . . 20.0 112.669 176.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.37 134.91 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.672 2.248 . . . . 20.0 112.291 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -79.66 112.61 2.95 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.603 2.869 . . . . 20.0 110.878 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.994 1.718 . . . . 20.0 110.784 179.577 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.475 0.777 0 CA-C-O 118.661 -0.685 . . . . 20.0 109.677 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.86 8.04 5.13 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 116.27 1.952 . . . . 20.0 116.27 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -63.04 -36.79 84.75 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 113.823 1.045 . . . . 20.0 113.823 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.7 88.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.827 -0.546 . . . . 20.0 111.109 174.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -68.07 -42.39 80.53 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.003 0.521 . . . . 20.0 111.779 175.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -49.92 -47.79 52.1 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.237 0.615 . . . . 20.0 112.068 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.2 -44.89 94.08 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.318 0.858 . . . . 20.0 113.318 174.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -53.49 -39.45 64.56 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.372 1.069 . . . . 20.0 113.023 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.94 16.24 0.32 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 124.658 1.183 . . . . 20.0 114.037 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.63 27.98 40.65 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 120.027 -1.67 . . . . 20.0 112.662 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.4 -118.13 11.74 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 125.531 1.539 . . . . 20.0 111.985 -176.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -75.02 -7.07 18.82 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.392 2.061 . . . . 20.0 113.178 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -56.65 -34.84 67.73 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.701 1.2 . . . . 20.0 113.367 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.11 -8.35 37.47 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.612 1.565 . . . . 20.0 114.736 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.86 3.33 90.52 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-N 119.219 0.918 . . . . 20.0 114.437 -173.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -89.5 134.29 32.88 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 124.734 1.214 . . . . 20.0 110.477 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -72.3 152.81 55.95 Favored 'Trans proline' 0 CA--C 1.547 1.154 0 C-N-CA 122.097 1.865 . . . . 20.0 112.314 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.62 124.41 10.71 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.97 3.113 . . . . 20.0 111.99 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -81.1 88.34 1.39 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.373 2.715 . . . . 20.0 112.085 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 C--O 1.245 0.849 0 C-N-CA 126.15 1.78 . . . . 20.0 111.707 179.442 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 118.266 -0.873 . . . . 20.0 108.868 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.3 -0.02 11.6 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.713 1.205 . . . . 20.0 113.297 177.167 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -68.33 -39.64 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.403 1.081 . . . . 20.0 111.771 -175.003 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.58 85.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.242 0.617 . . . . 20.0 111.836 173.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -44.83 86.47 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.291 0.636 . . . . 20.0 111.182 176.019 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -52.19 -46.91 65.77 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.024 0.529 . . . . 20.0 112.123 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -41.13 98.73 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.957 0.725 . . . . 20.0 112.957 174.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -39.66 66.97 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.133 0.973 . . . . 20.0 112.878 177.697 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -82.96 25.75 0.66 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.547 1.539 . . . . 20.0 113.988 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.71 27.31 59.12 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.938 1.256 . . . . 20.0 113.031 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.92 -115.39 6.41 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.22 1.39 . . . . 20.0 111.465 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -77.24 -5.96 16.12 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 122.292 1.994 . . . . 20.0 113.49 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.3 m -58.22 -34.06 70.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.63 1.172 . . . . 20.0 113.625 -173.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -5.03 44.74 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.403 1.881 . . . . 20.0 113.642 176.603 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.66 8.14 86.07 Favored Glycine 0 CA--C 1.538 1.512 0 CA-C-N 119.495 1.043 . . . . 20.0 114.913 -177.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -83.41 131.99 51.15 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.69 1.596 . . . . 20.0 110.471 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.09 140.18 48.83 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.005 1.804 . . . . 20.0 111.107 174.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.62 143.23 61.54 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.832 2.355 . . . . 20.0 111.942 178.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.51 112.32 3.32 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.344 2.696 . . . . 20.0 110.87 177.047 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 126.944 2.098 . . . . 20.0 110.355 176.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.788 0.292 . . . . 20.0 111.788 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.36 -29.31 70.38 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.826 0.676 . . . . 20.0 112.826 176.681 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -59.03 -35.36 73.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.608 0.763 . . . . 20.0 112.472 177.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.63 88.6 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.325 0.65 . . . . 20.0 111.734 176.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.85 -42.3 63.88 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.975 0.51 . . . . 20.0 111.195 175.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.7 t90 -54.5 -44.14 72.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.798 . . . . 20.0 112.103 177.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -62.02 -39.22 91.56 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.596 -0.69 . . . . 20.0 112.652 174.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -30.44 63.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.083 1.353 . . . . 20.0 112.323 176.677 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -85.73 18.57 2.82 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.688 1.195 . . . . 20.0 113.018 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.82 27.38 67.05 Favored Glycine 0 C--N 1.348 1.204 0 C-N-CA 125.796 1.665 . . . . 20.0 113.003 -173.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.81 -118.44 14.67 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.185 0.898 . . . . 20.0 111.462 -176.181 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -81.3 6.08 5.83 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.05 2.5 . . . . 20.0 113.677 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.3 p -68.87 -33.96 74.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.054 1.297 . . . . 20.0 113.468 -177.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -10.29 59.61 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.148 0.979 . . . . 20.0 113.031 177.285 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.09 16.26 79.04 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 123.771 0.7 . . . . 20.0 114.025 -176.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.16 133.58 31.5 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 125.338 1.455 . . . . 20.0 110.927 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.66 135.18 37.78 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.095 1.863 . . . . 20.0 111.392 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.0 136.44 65.51 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.61 2.874 . . . . 20.0 112.261 177.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -82.77 82.76 2.12 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.778 2.985 . . . . 20.0 111.39 -179.248 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 56.5 m . . . . . 0 C--O 1.248 1.006 0 CA-C-O 116.896 -1.526 . . . . 20.0 111.515 -179.327 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 119.24 -0.41 . . . . 20.0 111.105 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.97 4.28 2.5 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.457 1.103 . . . . 20.0 113.555 176.216 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.83 -37.5 87.6 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.466 1.106 . . . . 20.0 113.18 -172.385 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.33 -47.04 82.58 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.352 0.661 . . . . 20.0 111.294 175.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -67.02 -42.31 85.14 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.648 0.779 . . . . 20.0 111.588 175.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -50.29 -50.84 49.25 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.864 0.866 . . . . 20.0 111.597 175.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.52 -45.19 94.72 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 119.154 -0.45 . . . . 20.0 112.163 173.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -54.09 -39.71 66.6 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.754 1.222 . . . . 20.0 113.095 178.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -75.39 12.64 0.92 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.547 1.539 . . . . 20.0 113.674 177.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.27 27.96 31.86 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 120.423 -1.423 . . . . 20.0 112.762 -176.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.19 -117.25 10.46 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.567 1.556 . . . . 20.0 111.882 -177.207 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.98 -7.4 19.15 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.404 2.069 . . . . 20.0 113.364 -179.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.2 m -54.96 -34.24 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.772 1.229 . . . . 20.0 113.505 -174.64 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.02 -9.42 52.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.68 1.992 . . . . 20.0 114.474 176.248 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.14 8.96 87.01 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.086 0.857 . . . . 20.0 114.466 -174.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -92.35 131.23 35.04 Favored Pre-proline 0 CA--C 1.539 0.558 0 C-N-CA 125.017 1.327 . . . . 20.0 110.628 178.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -65.34 149.74 87.96 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 121.938 1.758 . . . . 20.0 112.176 174.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.45 128.34 16.17 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.827 3.018 . . . . 20.0 112.068 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -78.04 88.76 1.4 Allowed 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.523 2.815 . . . . 20.0 111.185 -178.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.251 1.173 0 CA-C-O 116.661 -1.637 . . . . 20.0 111.188 177.355 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 117.926 -1.035 . . . . 20.0 111.27 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.06 -0.05 23.21 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.594 1.331 . . . . 20.0 114.594 -172.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.37 -37.62 85.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.694 1.198 . . . . 20.0 113.438 -174.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.24 -44.75 88.41 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.314 0.646 . . . . 20.0 111.249 174.141 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -66.75 -41.31 88.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.006 0.522 . . . . 20.0 111.56 175.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 t90 -53.52 -49.45 67.56 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.215 0.461 . . . . 20.0 111.751 174.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.53 -40.95 98.43 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 118.585 -0.721 . . . . 20.0 112.923 174.421 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -53.55 -36.09 61.45 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.039 1.126 . . . . 20.0 114.039 176.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -79.77 10.83 3.66 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.728 1.211 . . . . 20.0 113.642 175.792 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.45 25.75 32.3 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 120.51 -1.369 . . . . 20.0 112.698 -176.319 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.39 -114.93 6.0 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.251 1.405 . . . . 20.0 111.772 -177.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.17 -6.51 15.76 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.261 1.974 . . . . 20.0 113.472 -179.553 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -56.59 -40.29 75.02 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.58 1.082 . . . . 20.0 113.478 -175.352 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -7.68 21.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 127.409 2.284 . . . . 20.0 114.909 174.364 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.26 10.94 84.41 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.714 1.143 . . . . 20.0 114.481 -175.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -90.44 134.34 31.25 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 125.322 1.449 . . . . 20.0 110.628 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.71 143.77 57.33 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.037 1.825 . . . . 20.0 111.582 178.143 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.04 141.72 49.0 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.05 2.5 . . . . 20.0 111.482 177.264 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.07 129.48 10.57 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.895 2.397 . . . . 20.0 111.003 177.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.1 p . . . . . 0 C--O 1.259 1.582 0 CA-C-O 114.816 -2.516 . . . . 20.0 110.641 175.71 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 25.1 p-10 . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 119.147 -0.454 . . . . 20.0 110.94 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.56 5.57 12.69 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.014 1.726 . . . . 20.0 114.658 -171.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -62.06 -37.63 85.71 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.001 1.32 . . . . 20.0 113.299 -172.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.18 88.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.352 0.661 . . . . 20.0 111.48 174.043 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -69.27 -42.32 75.69 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.457 0.703 . . . . 20.0 111.512 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -49.82 -51.64 38.29 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.868 0.867 . . . . 20.0 111.851 172.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.4 mt -59.79 -46.02 90.5 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 118.822 -0.609 . . . . 20.0 112.545 173.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -52.68 -43.28 65.47 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.844 0.858 . . . . 20.0 113.075 175.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -71.25 17.03 0.08 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.298 1.439 . . . . 20.0 114.01 175.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.68 21.28 56.47 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 120.007 -1.683 . . . . 20.0 113.163 -178.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.99 -120.53 15.34 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.364 1.459 . . . . 20.0 111.706 -177.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.44 -9.13 21.36 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.351 2.034 . . . . 20.0 113.388 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 t -76.07 -12.69 60.17 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.442 1.275 . . . . 20.0 114.442 -171.987 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.7 m -95.3 15.74 18.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.41 1.084 . . . . 20.0 113.885 179.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.26 16.41 73.25 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.261 -0.9 . . . . 20.0 114.088 177.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -112.91 128.05 26.09 Favored Pre-proline 0 CA--C 1.537 0.461 0 C-N-CA 125.485 1.514 . . . . 20.0 110.429 -170.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -71.35 146.68 51.17 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.156 1.904 . . . . 20.0 111.696 -176.175 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.84 130.96 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.22 2.613 . . . . 20.0 112.091 178.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -73.93 96.68 0.94 Allowed 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.436 2.757 . . . . 20.0 110.379 178.011 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 116.889 -1.529 . . . . 20.0 111.205 174.479 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.472 0.64 0 CA-C-O 117.518 -1.23 . . . . 20.0 108.999 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.58 -35.41 7.06 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.142 1.164 . . . . 20.0 114.142 -177.092 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.35 -35.37 71.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.99 0.916 . . . . 20.0 113.324 -176.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.26 -42.11 76.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.386 1.074 . . . . 20.0 112.223 173.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -73.54 -40.78 63.73 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.128 0.571 . . . . 20.0 111.126 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.8 t90 -53.93 -47.69 70.97 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.466 0.706 . . . . 20.0 112.242 175.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.8 mt -58.73 -39.69 81.6 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.853 0.686 . . . . 20.0 112.853 174.585 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -34.08 69.49 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.038 1.335 . . . . 20.0 112.742 177.954 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -84.09 24.57 0.92 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.292 1.837 . . . . 20.0 113.241 174.237 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.06 24.63 76.22 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 120.931 -1.106 . . . . 20.0 112.848 -179.092 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 54.84 -112.7 2.98 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.458 1.504 . . . . 20.0 111.495 -174.543 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.85 -10.48 19.86 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.075 1.85 . . . . 20.0 113.255 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.1 t -58.09 -42.67 86.1 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.37 0.986 . . . . 20.0 113.372 -174.473 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.9 m -70.73 3.0 3.5 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.887 1.439 . . . . 20.0 114.887 174.539 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.0 9.61 85.28 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.188 1.358 . . . . 20.0 114.547 178.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -89.12 129.33 48.38 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.538 1.935 . . . . 20.0 109.974 -179.203 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.21 146.65 76.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.857 1.705 . . . . 20.0 111.201 176.302 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.46 134.03 31.97 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.922 2.414 . . . . 20.0 111.746 179.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.25 100.64 1.39 Allowed 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.324 2.683 . . . . 20.0 110.871 176.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.2 m . . . . . 0 C--O 1.25 1.08 0 CA-C-O 116.455 -1.736 . . . . 20.0 111.849 167.72 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.07 7.2 2.01 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.271 1.028 . . . . 20.0 113.345 171.807 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.01 -38.79 87.31 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.602 1.161 . . . . 20.0 113.075 -173.449 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.37 -33.01 73.89 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.793 0.837 . . . . 20.0 112.718 176.303 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -76.76 -43.69 35.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.633 0.773 . . . . 20.0 110.673 172.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 53.4 t90 -50.02 -50.44 47.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.379 0.672 . . . . 20.0 111.746 175.666 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.54 -39.04 89.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.092 0.775 . . . . 20.0 113.092 173.714 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.09 -41.46 78.93 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.608 1.163 . . . . 20.0 112.338 177.207 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -79.04 18.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.595 1.558 . . . . 20.0 114.151 176.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.76 22.11 54.11 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.825 1.202 . . . . 20.0 113.489 178.671 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.82 -116.25 8.73 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 124.525 1.059 . . . . 20.0 110.751 -175.359 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.69 -10.77 17.06 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.059 1.839 . . . . 20.0 113.646 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.4 m -58.74 -30.04 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.021 1.282 . . . . 20.0 114.196 -175.123 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.19 -3.46 39.69 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.302 1.441 . . . . 20.0 113.562 175.502 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 76.43 5.88 83.02 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 119.548 1.067 . . . . 20.0 114.489 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -83.09 130.82 55.76 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 126.759 2.023 . . . . 20.0 110.165 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.06 143.83 67.12 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.053 1.835 . . . . 20.0 111.397 174.692 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.95 134.76 33.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.023 2.482 . . . . 20.0 111.568 178.542 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.12 127.46 9.26 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.111 2.541 . . . . 20.0 110.826 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.253 1.249 0 CA-C-O 113.08 -3.343 . . . . 20.0 113.57 172.312 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 117.897 -1.049 . . . . 20.0 111.161 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.12 5.29 0.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 116.949 2.203 . . . . 20.0 116.949 178.263 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -61.21 -41.4 96.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.789 1.635 . . . . 20.0 113.674 -171.33 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -44.72 80.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.528 0.731 . . . . 20.0 111.739 174.607 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -68.67 -40.63 80.07 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.471 0.708 . . . . 20.0 111.478 177.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -53.7 -51.01 64.62 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.276 0.63 . . . . 20.0 111.969 171.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.3 mt -58.97 -42.25 89.49 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.633 -0.667 . . . . 20.0 112.357 174.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -18.56 48.6 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.225 1.565 . . . . 20.0 115.225 177.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -95.89 20.1 10.46 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.302 2.241 . . . . 20.0 112.152 172.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.77 24.09 68.07 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 120.734 -1.229 . . . . 20.0 112.709 -177.187 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.51 -114.71 5.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.556 1.074 . . . . 20.0 111.279 -174.177 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -76.83 -9.67 18.23 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 121.935 1.757 . . . . 20.0 113.408 -178.128 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -32.8 70.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.499 1.296 . . . . 20.0 114.499 -175.361 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -79.12 11.03 3.01 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.998 1.11 . . . . 20.0 113.998 175.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 74.3 17.44 79.68 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.057 -1.027 . . . . 20.0 113.984 177.262 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -109.56 131.74 21.72 Favored Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 125.193 1.397 . . . . 20.0 110.238 -172.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -72.26 151.17 54.24 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.994 1.796 . . . . 20.0 111.833 -176.725 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.22 125.67 12.71 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.451 2.767 . . . . 20.0 111.638 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -81.36 111.28 2.34 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.288 2.658 . . . . 20.0 111.66 177.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.9 p . . . . . 0 C--O 1.248 1.025 0 C-N-CA 126.058 1.743 . . . . 20.0 110.681 177.12 . . . . . . . . 0 0 . 1 stop_ save_