data_6so0_residue ############################ # Computer software used # ############################ 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 6so0 _Structure_validation_residue.Date_analyzed 2020-01-10 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 ' 4' ' ' THR . . . . . . . . . . . . . 25.6 p . . . . . 0 C--O 1.222 -0.369 0 N-CA-C 112.632 0.604 . . . . 25.0 112.632 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -54.5 -37.61 65.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.054 1.501 . . . . 50.0 115.054 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.44 3.88 15.1 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.939 0.4 . . . . 25.0 112.05 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.56 122.09 19.88 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.631 -0.668 . . . . 50.0 109.812 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.64 -1.45 82.84 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 121.078 -0.582 . . . . 25.0 113.643 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -82.52 143.9 30.77 Favored 'General case' 0 CA--C 1.508 -0.664 0 O-C-N 122.275 -0.544 . . . . 50.0 111.61 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.76 158.47 32.32 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 171.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -67.23 175.3 2.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.881 -0.599 . . . . 50.0 111.404 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.15 -178.86 19.32 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 110.73 -0.948 . . . . 50.0 110.73 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 mt -100.88 149.28 24.03 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.135 0.493 . . . . 50.0 112.192 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -130.07 151.68 78.76 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.378 0.671 . . . . 50.0 109.676 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.31 146.47 63.12 Favored 'Trans proline' 0 C--N 1.352 0.752 0 N-CA-C 115.11 1.158 . . . . 50.0 115.11 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -90.77 155.87 45.18 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 114.655 -1.157 . . . . 50.0 110.71 -176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -89.87 -17.94 1.58 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 N-CA-C 117.743 2.17 . . . . 50.0 117.743 -173.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -137.0 -50.42 0.65 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 117.3 2.333 . . . . 50.0 117.3 -168.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -74.41 164.08 27.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.531 0.567 . . . . 50.0 112.531 -171.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -65.76 -44.34 86.16 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 115.357 1.614 . . . . 50.0 115.357 -176.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 m -143.43 35.29 1.32 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.046 1.499 . . . . 50.0 115.046 -174.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.7 p -98.05 171.31 8.33 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.689 -1.597 . . . . 50.0 106.689 175.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -147.48 172.66 13.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.471 0.653 . . . . 50.0 109.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -105.95 148.42 27.67 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 103.761 -2.681 . . . . 50.0 103.761 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -134.16 139.99 46.25 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.874 -1.899 . . . . 50.0 105.874 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -116.15 129.57 56.38 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.48 -0.933 . . . . 25.0 108.48 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.97 114.54 9.82 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.813 -1.18 . . . . 25.0 107.813 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.25 38.52 27.86 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.212 0.605 . . . . 25.0 112.168 -178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.63 1.91 73.41 Favored Glycine 0 N--CA 1.465 0.593 0 N-CA-C 115.316 0.886 . . . . 25.0 115.316 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -98.52 148.02 24.18 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 107.56 -1.274 . . . . 50.0 107.56 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.1 tp -100.98 132.81 46.22 Favored 'General case' 0 C--O 1.218 -0.576 0 O-C-N 123.799 0.687 . . . . 50.0 111.539 -176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -119.67 142.73 48.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.688 -1.597 . . . . 50.0 106.688 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -122.45 115.76 22.79 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.056 -2.201 . . . . 50.0 105.056 174.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -139.79 171.04 14.79 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.646 -0.502 . . . . 50.0 109.646 -171.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -110.66 155.72 22.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.41 0.893 . . . . 50.0 113.41 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.19 89.94 22.38 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 105.292 -2.114 . . . . 50.0 105.292 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.49 -52.33 0.05 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 0 N-CA-C 118.846 2.595 . . . . 50.0 118.846 -166.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 m -104.24 106.68 17.26 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.32 1.6 . . . . 25.0 115.32 -170.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.88 -4.89 14.34 Favored Glycine 0 N--CA 1.467 0.703 0 N-CA-C 114.318 0.487 . . . . 25.0 114.318 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.26 136.47 34.52 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.226 0.61 . . . . 25.0 110.868 -175.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.7 m -131.5 149.6 33.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 108.528 -0.916 . . . . 50.0 108.528 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -80.49 138.64 36.58 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.652 -0.499 . . . . 50.0 109.652 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -119.37 113.44 20.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.976 0.893 . . . . 50.0 110.086 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.8 -19.91 65.38 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.154 0.798 . . . . 25.0 113.154 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.2 p -75.18 -36.02 61.5 Favored 'General case' 0 C--O 1.219 -0.533 0 O-C-N 122.005 -0.435 . . . . 50.0 111.722 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.1 p -102.07 -7.78 21.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.635 0.976 . . . . 25.0 113.635 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 mptt 57.82 36.9 26.84 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 106.995 -1.483 . . . . 50.0 106.995 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.3 p -140.9 166.49 24.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 25.0 108.872 -174.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.1 t -113.98 137.27 51.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.333 -2.099 . . . . 50.0 105.333 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.1 t -141.0 160.23 40.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.136 0.493 . . . . 25.0 109.737 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 . . . . . 0 C--N 1.321 -0.638 0 N-CA-C 107.949 -1.13 . . . . 50.0 107.949 177.472 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.362 0 N-CA-C 116.372 1.989 . . . . 25.0 116.372 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.85 -33.6 72.01 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.781 0.66 . . . . 50.0 112.781 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -109.61 8.04 24.79 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.165 0.507 . . . . 25.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -78.14 126.85 31.41 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 121.248 -0.908 . . . . 50.0 108.731 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 21.12 80.05 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.455 -0.878 . . . . 25.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -118.48 146.79 44.23 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.137 -1.06 . . . . 50.0 108.137 178.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 150.94 46.52 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 106.988 -1.486 . . . . 25.0 106.988 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.95 148.45 46.0 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 106.973 -1.491 . . . . 50.0 106.973 174.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -168.25 25.54 Favored Glycine 0 C--N 1.316 -0.578 0 N-CA-C 109.28 -1.528 . . . . 50.0 109.28 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.0 mt -105.76 147.17 28.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.218 0.509 . . . . 50.0 110.86 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -129.49 150.8 76.64 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.164 -0.471 . . . . 50.0 109.773 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.9 141.61 37.32 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 117.758 -1.028 . . . . 50.0 114.206 -178.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -92.04 133.32 30.58 Favored Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 104.34 -2.467 . . . . 50.0 104.34 172.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -73.5 -19.0 22.3 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 115.247 1.21 . . . . 50.0 115.247 -175.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -97.94 -35.86 10.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.306 0.574 . . . . 50.0 111.685 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.09 158.89 17.8 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 113.38 0.882 . . . . 50.0 113.38 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -100.68 -42.38 6.54 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 112.489 0.552 . . . . 50.0 112.489 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.0 m -113.27 -25.6 8.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.747 0.647 . . . . 50.0 112.747 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 10.4 m -78.17 151.08 33.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.549 -0.908 . . . . 50.0 108.549 177.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -141.25 172.84 12.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.424 0.631 . . . . 50.0 111.756 -171.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -100.38 151.79 21.11 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.18 -2.526 . . . . 50.0 104.18 170.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.0 t -142.7 145.7 33.64 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 108.781 -0.822 . . . . 50.0 108.781 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.3 m -126.43 136.22 52.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.01 -1.478 . . . . 25.0 107.01 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.72 117.96 7.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.693 -1.225 . . . . 25.0 107.693 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.07 34.59 20.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.064 0.946 . . . . 25.0 110.384 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.34 2.95 69.13 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 115.975 -0.557 . . . . 25.0 113.507 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -90.38 144.89 25.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.026 -1.472 . . . . 50.0 107.026 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.38 133.77 34.78 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 123.245 0.34 . . . . 50.0 110.567 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.81 139.89 52.77 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 106.634 -1.617 . . . . 50.0 106.634 169.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -123.6 115.82 22.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.601 -2.74 . . . . 50.0 103.601 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.93 165.72 26.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 50.0 110.817 -169.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.7 p -109.34 154.76 22.07 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.184 -0.462 . . . . 50.0 111.466 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -116.13 98.3 51.04 Favored Pre-proline 0 C--N 1.317 -0.83 0 N-CA-C 103.981 -2.6 . . . . 50.0 103.981 171.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.39 -92.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.311 0 N-CA-C 117.666 2.141 . . . . 50.0 117.666 -164.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.525 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.6 OUTLIER -72.45 114.91 11.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.09 -1.631 . . . . 25.0 114.448 -167.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.31 8.75 85.73 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 115.558 0.983 . . . . 25.0 115.558 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.1 mt -122.12 154.71 37.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.146 0.498 . . . . 25.0 112.101 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.4 m -139.0 160.6 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 107.483 -1.303 . . . . 50.0 107.483 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -87.79 142.83 27.51 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.693 -0.803 . . . . 50.0 108.919 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.3 t -126.02 107.31 10.31 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.539 0.685 . . . . 50.0 110.472 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -65.33 -25.09 67.46 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.516 -0.766 . . . . 25.0 112.618 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -65.07 -29.99 70.91 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.498 0.555 . . . . 50.0 112.498 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.92 -2.09 18.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.565 0.166 . . . . 25.0 111.445 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 54.14 37.55 27.32 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.47 -0.567 . . . . 50.0 109.47 -172.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.65 167.9 21.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 25.0 109.971 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.0 t -97.4 140.3 32.07 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.418 -1.697 . . . . 50.0 106.418 175.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 80.6 p -137.89 168.44 19.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.508 0.67 . . . . 25.0 111.781 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.8 m95 . . . . . 0 C--N 1.317 -0.839 0 N-CA-C 106.604 -1.628 . . . . 50.0 106.604 168.753 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.217 -0.61 0 CA-C-O 121.355 0.597 . . . . 25.0 110.795 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -55.69 -37.07 67.86 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.747 0.819 . . . . 50.0 112.748 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.0 t -107.18 -9.76 16.04 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.464 0.65 . . . . 25.0 112.063 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -73.33 128.16 34.7 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.203 -0.936 . . . . 50.0 109.066 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.52 6.2 89.36 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.827 -0.701 . . . . 25.0 112.602 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -94.92 145.71 24.73 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.115 -0.698 . . . . 50.0 109.115 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.91 148.19 44.58 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.937 -2.246 . . . . 25.0 104.937 172.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -66.59 146.19 54.77 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.523 -1.288 . . . . 50.0 107.523 176.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.59 -177.96 22.8 Favored Glycine 0 C--O 1.238 0.349 0 N-CA-C 110.383 -1.087 . . . . 50.0 110.383 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.9 mt -100.71 139.92 35.71 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.184 0.809 . . . . 50.0 113.184 -177.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -124.97 146.31 53.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 108.103 -1.073 . . . . 50.0 108.103 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.81 150.57 62.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 N-CA-C 114.336 0.86 . . . . 50.0 114.336 -175.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -98.98 132.81 22.91 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 116.242 -0.436 . . . . 50.0 110.208 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.45 -19.3 10.33 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.373 1.259 . . . . 50.0 115.373 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -88.53 -39.17 14.36 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.266 0.469 . . . . 50.0 112.266 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -118.82 148.85 42.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.555 0.693 . . . . 50.0 112.611 -173.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -58.34 6.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.144 -0.934 . . . . 50.0 113.014 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.1 m -98.06 12.05 35.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 115.718 1.747 . . . . 50.0 115.718 -172.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.9 p -103.98 164.95 11.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.329 -0.548 . . . . 50.0 110.152 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -146.07 173.66 11.99 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.793 0.806 . . . . 50.0 109.853 -177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -107.9 140.44 41.02 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 103.333 -2.839 . . . . 50.0 103.333 170.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.9 t -126.24 122.39 35.4 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.817 -1.179 . . . . 50.0 107.817 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.1 m -97.87 127.7 43.99 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.345 -2.094 . . . . 25.0 105.345 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.38 115.04 7.7 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.498 -1.297 . . . . 25.0 107.498 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.96 34.52 22.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.784 0.834 . . . . 25.0 111.479 -176.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.45 13.23 80.11 Favored Glycine 0 C--O 1.239 0.437 0 C-N-CA 120.986 -0.626 . . . . 25.0 114.069 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 mmt-85 -106.71 146.38 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.975 -1.861 . . . . 50.0 105.975 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.45 109.99 22.07 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.226 0.329 . . . . 50.0 111.08 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -101.53 135.44 43.04 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.964 -1.495 . . . . 50.0 106.964 173.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -113.87 109.46 18.56 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 105.437 -2.061 . . . . 50.0 105.437 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -141.84 -179.44 6.2 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.884 -0.784 . . . . 50.0 108.884 -169.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.4 p -136.94 164.67 27.78 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.949 0.722 . . . . 50.0 112.949 -177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.32 80.94 37.44 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.523 -1.288 . . . . 50.0 107.523 175.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -82.53 -74.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.03 0 N-CA-C 117.123 1.932 . . . . 50.0 117.123 -173.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.45 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.2 OUTLIER -77.33 115.29 16.99 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 114.004 1.112 . . . . 25.0 114.004 -172.286 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.56 11.62 80.29 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.871 -0.68 . . . . 25.0 114.576 173.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.3 mt -133.36 154.73 50.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.202 0.501 . . . . 25.0 110.469 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.7 m -141.46 157.69 21.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 107.96 -1.126 . . . . 50.0 107.96 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -93.79 126.4 38.95 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.728 -0.607 . . . . 50.0 109.799 177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.1 t -106.75 96.3 6.35 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.584 -0.895 . . . . 50.0 108.584 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -60.94 -27.82 68.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 25.0 111.533 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -31.17 72.27 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.03 0.752 . . . . 50.0 113.03 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 2.3 p -103.21 -8.83 20.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.715 0.293 . . . . 25.0 110.879 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 tptt 64.8 23.07 12.64 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.911 0.885 . . . . 50.0 111.481 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.13 169.17 16.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.113 -0.949 . . . . 25.0 111.409 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.2 t -93.35 139.39 30.72 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.911 -1.885 . . . . 50.0 105.911 173.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.3 p -128.4 161.46 29.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.071 0.463 . . . . 25.0 110.537 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.4 t90 . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 50.0 111.919 -178.903 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.3 p . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.648 0.737 . . . . 25.0 111.037 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -47.76 -52.92 16.88 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.868 1.062 . . . . 50.0 113.868 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.21 -1.93 15.94 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.834 0.679 . . . . 25.0 112.834 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -66.75 138.59 57.49 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 120.783 -1.198 . . . . 50.0 109.067 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.03 4.01 90.39 Favored Glycine 0 C--O 1.247 0.919 0 C-N-CA 121.093 -0.575 . . . . 25.0 113.181 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -113.92 154.94 26.69 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 106.075 -1.824 . . . . 50.0 106.075 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.75 151.7 46.94 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.205 -0.665 . . . . 25.0 109.205 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.49 131.68 48.91 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.836 -1.542 . . . . 50.0 106.836 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 158.92 -177.42 35.51 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 110.724 -0.95 . . . . 50.0 110.724 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.6 mt -97.32 147.82 23.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.34 . . . . 50.0 110.571 -178.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -134.21 146.65 60.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 109.082 -0.71 . . . . 50.0 109.082 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -71.35 149.44 56.84 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 117.908 -0.928 . . . . 50.0 114.32 -172.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -95.74 129.63 33.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 106.388 -1.708 . . . . 50.0 106.388 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -80.84 -16.71 10.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 N-CA-C 114.884 1.071 . . . . 50.0 114.884 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -92.53 -39.08 11.57 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.727 0.411 . . . . 50.0 111.219 -176.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -110.54 171.7 7.3 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.717 0.77 . . . . 50.0 109.957 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -109.63 -36.48 5.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.655 -0.702 . . . . 50.0 112.81 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 t -86.9 -26.09 24.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.169 -0.923 . . . . 50.0 112.743 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 55.6 p -89.39 158.77 17.63 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 121.367 -0.833 . . . . 50.0 110.698 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -139.26 169.54 17.58 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.538 0.685 . . . . 50.0 109.3 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -103.56 150.03 24.32 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 102.914 -2.995 . . . . 50.0 102.914 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.8 t -140.13 141.2 36.1 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.916 -1.513 . . . . 50.0 106.916 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t -117.05 122.51 44.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.16 120.26 12.87 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.79 34.91 24.36 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.8 0.809 . . . . 25.0 112.01 -177.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.91 3.56 84.49 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.956 -0.566 . . . . 25.0 114.478 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -102.05 138.8 38.53 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.046 -1.094 . . . . 50.0 108.046 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.58 119.22 26.6 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.983 -0.747 . . . . 50.0 108.983 178.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -109.58 143.66 38.97 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.32 -1.733 . . . . 50.0 106.32 172.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -128.66 116.79 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.203 -2.147 . . . . 50.0 105.203 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -145.3 169.07 18.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.252 0.478 . . . . 50.0 110.464 -172.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.6 p -107.6 157.81 17.75 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.998 0.519 . . . . 50.0 111.64 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.17 88.3 31.9 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 107.391 -1.337 . . . . 50.0 107.391 173.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.77 -78.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.29 0 N-CA-C 119.486 2.841 . . . . 50.0 119.486 -170.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.08 96.39 1.06 Allowed 'General case' 0 C--O 1.242 0.66 0 N-CA-C 116.534 2.05 . . . . 25.0 116.534 -166.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.81 13.21 83.29 Favored Glycine 0 C--O 1.22 -0.749 0 CA-C-N 114.978 -1.01 . . . . 25.0 112.568 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.6 mt -107.03 137.75 44.5 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.638 0.732 . . . . 25.0 112.697 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.3 m -133.09 147.87 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.417 -0.81 . . . . 50.0 110.241 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -90.88 134.7 34.26 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.132 0.491 . . . . 50.0 110.732 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.7 t -114.02 102.68 10.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.649 1.214 . . . . 50.0 109.705 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.38 -24.18 64.75 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.688 0.996 . . . . 25.0 113.688 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 p -64.93 -35.63 81.77 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 111.689 0.255 . . . . 50.0 111.689 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.3 p -110.91 -2.54 15.99 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 113.706 1.002 . . . . 25.0 113.706 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 61.85 33.38 17.68 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.716 0.807 . . . . 50.0 111.152 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -113.52 166.72 11.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.091 0.472 . . . . 25.0 109.758 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -114.68 129.44 56.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 102.97 -2.974 . . . . 50.0 102.97 165.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.9 p -124.51 157.68 34.73 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.727 -0.471 . . . . 25.0 109.727 -174.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 4.1 t90 . . . . . 0 N--CA 1.445 -0.698 0 N-CA-C 108.596 -0.89 . . . . 50.0 108.596 176.179 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 C--O 1.217 -0.618 0 CA-C-O 120.873 0.368 . . . . 25.0 111.956 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -57.83 -31.08 66.29 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.082 1.142 . . . . 50.0 114.082 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 m -111.69 2.0 17.0 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.654 0.613 . . . . 25.0 112.654 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -78.95 134.14 36.85 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.878 -1.527 . . . . 50.0 106.878 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.62 4.29 89.14 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.767 -0.73 . . . . 25.0 112.008 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -113.32 148.96 34.65 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 108.476 -0.935 . . . . 50.0 108.476 176.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 150.79 43.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.048 -1.834 . . . . 25.0 106.048 173.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.06 150.02 48.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.796 -1.187 . . . . 50.0 107.796 176.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -171.44 24.3 Favored Glycine 0 C--O 1.237 0.294 0 N-CA-C 110.241 -1.143 . . . . 50.0 110.241 -176.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.7 mt -105.94 141.0 38.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.558 0.694 . . . . 50.0 112.464 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -124.4 150.3 63.93 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 107.908 -1.145 . . . . 50.0 107.908 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -67.75 147.4 75.35 Favored 'Trans proline' 0 C--N 1.35 0.625 0 N-CA-C 114.325 0.856 . . . . 50.0 114.325 -176.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -92.04 154.96 43.41 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 114.86 -1.064 . . . . 50.0 111.175 -177.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.0 -33.24 19.97 Favored 'Trans proline' 0 CA--C 1.545 1.049 0 N-CA-C 116.71 1.773 . . . . 50.0 116.71 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -162.3 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 113.698 0.999 . . . . 50.0 113.698 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 36.25 -105.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.718 1.377 . . . . 50.0 114.718 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 -61.86 0.12 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.088 0.471 . . . . 50.0 111.545 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.7 p -150.94 37.94 0.65 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.169 0.985 . . . . 50.0 110.243 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.0 p -98.8 168.91 9.83 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.478 -1.237 . . . . 50.0 109.662 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -145.68 172.73 12.85 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.848 -0.797 . . . . 50.0 108.848 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -102.76 137.17 41.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 102.86 -3.015 . . . . 50.0 102.86 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.1 t -126.72 135.47 51.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.468 -0.938 . . . . 50.0 108.468 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.8 m -113.69 127.75 56.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.545 -1.65 . . . . 25.0 106.545 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.48 122.12 12.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.52 31.59 17.39 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 124.07 0.948 . . . . 25.0 110.969 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.37 11.83 79.86 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.864 -0.607 . . . . 25.0 114.231 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -108.9 151.1 26.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.174 -1.047 . . . . 50.0 108.174 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 49.5 tp -92.29 129.51 38.21 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.317 0.385 . . . . 50.0 111.907 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -122.69 134.11 54.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.342 -2.096 . . . . 50.0 105.342 167.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -113.95 112.69 23.72 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 104.852 -2.277 . . . . 50.0 104.852 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -140.44 173.44 11.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.577 -0.527 . . . . 50.0 109.577 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.5 p -122.51 159.51 27.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.737 1.014 . . . . 50.0 113.737 -177.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.89 72.11 62.49 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 107.444 -1.317 . . . . 50.0 107.444 177.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -82.88 -60.67 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.753 0 N-CA-C 117.62 2.123 . . . . 50.0 117.62 -170.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 p -80.63 111.04 16.69 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.938 1.088 . . . . 25.0 113.938 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.33 14.91 76.98 Favored Glycine 0 C--O 1.221 -0.684 0 C-N-CA 120.706 -0.759 . . . . 25.0 113.795 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.7 mt -124.93 149.57 47.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.782 0.791 . . . . 25.0 112.225 -171.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 m -139.16 148.77 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 122.839 0.456 . . . . 50.0 109.87 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -93.41 131.41 38.62 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.979 -0.451 . . . . 50.0 110.003 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.6 t -115.97 109.18 17.21 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.628 -0.879 . . . . 50.0 108.628 176.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -65.69 -28.27 68.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.367 0.506 . . . . 25.0 112.367 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.1 p -70.62 -34.57 72.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.687 0.28 . . . . 50.0 110.494 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.7 t -79.38 -21.85 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.655 -0.498 . . . . 25.0 109.655 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 59.31 29.73 19.33 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.412 -0.959 . . . . 50.0 108.412 -171.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.9 p -144.55 168.46 20.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.114 -0.948 . . . . 25.0 110.126 -174.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.1 t -105.23 134.77 47.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.714 -1.958 . . . . 50.0 105.714 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.8 p -121.03 159.9 24.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.935 0.398 . . . . 25.0 110.056 -176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.8 t90 . . . . . 0 C--N 1.321 -0.632 0 N-CA-C 106.799 -1.556 . . . . 50.0 106.799 175.081 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 121.329 0.585 . . . . 25.0 111.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -57.16 -44.6 83.62 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.855 1.058 . . . . 50.0 113.855 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 m -100.91 1.44 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.905 0.383 . . . . 25.0 111.931 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.47 134.64 39.47 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 107.604 -1.258 . . . . 50.0 107.604 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.17 13.72 81.54 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.988 -0.625 . . . . 25.0 112.482 -177.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -118.62 155.59 30.7 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.915 -1.143 . . . . 50.0 107.915 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.85 155.87 28.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 105.586 -2.005 . . . . 25.0 105.586 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -70.23 148.74 48.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.69 -1.226 . . . . 50.0 107.69 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.81 -173.39 24.05 Favored Glycine 0 C--O 1.238 0.394 0 N-CA-C 110.037 -1.225 . . . . 50.0 110.037 -176.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.7 mt -96.49 153.7 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.611 0.706 . . . . 50.0 110.551 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -135.46 149.02 68.33 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 107.925 -1.139 . . . . 50.0 107.925 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -67.11 144.31 68.83 Favored 'Trans proline' 0 C--N 1.355 0.904 0 N-CA-C 115.632 1.359 . . . . 50.0 115.632 -173.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 p-10 -83.73 154.22 64.83 Favored Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 114.358 -1.292 . . . . 50.0 110.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.83 -24.21 2.3 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 N-CA-C 118.442 2.439 . . . . 50.0 118.442 -172.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -140.48 -36.45 0.48 Allowed 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.641 2.089 . . . . 50.0 116.641 -170.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -76.91 176.71 8.33 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.711 -0.677 . . . . 50.0 111.341 -172.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -69.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.744 1.016 . . . . 50.0 113.744 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -113.61 16.59 18.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.054 1.502 . . . . 50.0 115.054 -172.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.4 p -79.93 172.01 14.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.363 -0.976 . . . . 50.0 108.363 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -156.61 170.73 21.72 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.37 0.605 . . . . 50.0 110.332 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -103.66 150.03 24.39 Favored 'General case' 0 CA--C 1.502 -0.866 0 N-CA-C 103.104 -2.924 . . . . 50.0 103.104 170.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.6 t -133.99 133.07 40.87 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.012 -1.477 . . . . 50.0 107.012 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.2 m -107.85 127.35 53.64 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.712 -1.958 . . . . 25.0 105.712 174.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.98 121.55 14.18 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.104 -1.443 . . . . 25.0 107.104 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.09 31.88 19.02 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.875 0.87 . . . . 25.0 110.034 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.54 9.55 69.26 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.885 -0.598 . . . . 25.0 114.533 -178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -103.56 150.01 24.35 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.064 -1.087 . . . . 50.0 108.064 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.1 tp -91.3 130.01 37.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.39 0.515 . . . . 50.0 112.39 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -122.86 134.74 54.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.74 -1.948 . . . . 50.0 105.74 167.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -113.94 123.31 49.44 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 104.959 -2.237 . . . . 50.0 104.959 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -138.57 161.31 37.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.959 0.409 . . . . 50.0 111.19 -174.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.0 p -110.43 141.22 43.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.349 -0.982 . . . . 50.0 108.349 177.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -98.99 127.81 33.99 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 102.909 -2.997 . . . . 50.0 102.909 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.74 -106.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 N-CA-C 116.052 1.52 . . . . 50.0 116.052 -166.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.2 t -105.58 152.82 22.6 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.448 -0.783 . . . . 25.0 112.372 -174.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.62 2.4 64.02 Favored Glycine 0 C--O 1.235 0.206 0 N-CA-C 114.767 0.667 . . . . 25.0 114.767 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.2 mt -131.58 155.28 47.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 25.0 111.279 -174.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.85 157.28 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 107.643 -1.244 . . . . 50.0 107.643 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -82.74 130.29 35.1 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 50.0 109.208 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.2 t -115.94 109.79 18.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.512 0.672 . . . . 50.0 109.631 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.49 -25.66 68.09 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.324 0.861 . . . . 25.0 113.324 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.4 p -66.5 -38.11 86.53 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.922 0.712 . . . . 50.0 112.922 -175.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.1 p -104.02 -8.23 19.72 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.391 -0.596 . . . . 25.0 109.391 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.4 tptt 63.29 33.01 14.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.108 -0.951 . . . . 50.0 112.044 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 163.84 20.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.424 -0.807 . . . . 25.0 110.271 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -86.86 125.13 33.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 102.898 -3.001 . . . . 50.0 102.898 165.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.2 p -121.24 161.75 21.41 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t90 . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.094 -0.957 . . . . 50.0 110.849 179.687 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.7 p . . . . . 0 C--O 1.218 -0.576 0 CA-C-O 120.949 0.404 . . . . 25.0 110.789 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.26 -35.84 60.48 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.756 1.762 . . . . 50.0 115.756 -174.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.7 t -105.11 -6.61 19.76 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.121 0.486 . . . . 25.0 111.244 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -71.83 127.45 32.59 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.264 -0.898 . . . . 50.0 109.138 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.55 5.39 88.46 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.977 -0.63 . . . . 25.0 113.28 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -107.68 145.51 33.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 117.475 0.637 . . . . 50.0 110.11 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.15 153.71 41.49 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.145 -1.057 . . . . 25.0 108.145 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -67.21 160.45 26.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.079 -0.51 . . . . 50.0 109.721 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.54 16.5 Favored Glycine 0 C--O 1.235 0.158 0 N-CA-C 110.601 -0.999 . . . . 50.0 110.601 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 mt -96.38 147.27 23.99 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.368 0.877 . . . . 50.0 113.368 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -129.77 151.72 78.61 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 106.201 -1.778 . . . . 50.0 106.201 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.59 144.44 60.52 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 117.799 -1.001 . . . . 50.0 113.815 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -80.99 158.08 70.58 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.875 0.87 . . . . 50.0 112.598 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -86.52 -23.67 1.72 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 N-CA-C 119.093 2.69 . . . . 50.0 119.093 -172.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -136.29 -44.72 0.62 Allowed 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 115.588 1.699 . . . . 50.0 115.588 -170.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -71.24 166.37 21.69 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.69 -1.141 . . . . 50.0 111.326 -173.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.9 tpt85 -77.2 -39.51 48.45 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.696 0.998 . . . . 50.0 113.696 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -128.39 3.73 5.68 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 118.95 2.944 . . . . 50.0 118.95 -167.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.8 p -85.89 178.07 7.41 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.301 -1.5 . . . . 50.0 109.265 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -143.14 170.98 14.71 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.456 0.646 . . . . 50.0 109.792 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -101.42 144.52 30.11 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 101.727 -3.434 . . . . 50.0 101.727 167.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -135.56 136.67 41.31 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 107.659 -1.237 . . . . 50.0 107.659 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.97 129.9 56.03 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.78 117.62 8.75 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.62 33.96 22.25 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.74 0.816 . . . . 25.0 110.815 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.75 5.49 74.52 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.299 -0.477 . . . . 25.0 114.179 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -100.87 144.59 29.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.243 -1.021 . . . . 50.0 108.243 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -91.31 128.67 37.23 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.289 -0.414 . . . . 50.0 111.61 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.27 133.74 55.15 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.186 -1.783 . . . . 50.0 106.186 169.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -116.21 107.81 15.34 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 104.88 -2.267 . . . . 50.0 104.88 175.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -146.5 172.84 12.95 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 120.469 0.176 . . . . 50.0 110.971 -169.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.5 p -114.17 164.13 14.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.224 -2.139 . . . . 50.0 105.224 171.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.55 127.64 55.82 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 106.782 -1.562 . . . . 50.0 106.782 178.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.33 -52.05 0.93 Allowed 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 116.489 -1.874 . . . . 50.0 116.335 -172.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.78 131.23 53.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.984 0.735 . . . . 25.0 112.984 -178.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.34 22.75 78.56 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.213 -0.994 . . . . 25.0 115.191 168.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.44 118.98 3.67 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -149.36 157.27 6.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 102.755 -3.054 . . . . 50.0 102.755 160.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -119.92 132.3 55.49 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.983 -1.117 . . . . 50.0 107.983 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.8 t -116.34 111.89 20.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.925 -0.768 . . . . 50.0 108.925 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -62.75 -30.42 71.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.596 -0.729 . . . . 25.0 111.991 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.3 p -67.78 -33.09 74.14 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 112.655 0.613 . . . . 50.0 112.655 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.1 -5.61 43.85 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.694 -0.484 . . . . 25.0 109.694 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.95 29.09 17.11 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.582 0.753 . . . . 50.0 109.671 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -141.88 166.57 24.35 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 113.663 0.986 . . . . 25.0 113.663 -167.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.8 t -79.91 138.48 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.685 -1.598 . . . . 50.0 106.685 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.3 p -124.33 167.98 13.61 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.939 -1.504 . . . . 25.0 106.939 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.07 0.462 . . . . 50.0 109.97 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.2 p . . . . . 0 N--CA 1.468 0.451 0 CA-C-O 121.283 0.564 . . . . 25.0 111.904 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -56.94 -43.67 81.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.268 0.84 . . . . 50.0 113.268 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.8 t -108.67 -16.41 14.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.386 0.613 . . . . 25.0 111.316 -178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -67.45 127.72 33.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 O-C-N 120.909 -1.119 . . . . 50.0 110.984 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.76 20.25 74.13 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 120.963 -0.637 . . . . 25.0 112.849 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -118.07 161.89 19.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.085 -1.45 . . . . 50.0 107.085 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.49 39.73 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.134 -1.802 . . . . 25.0 106.134 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -66.87 146.08 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.227 -1.397 . . . . 50.0 107.227 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.05 -178.36 25.69 Favored Glycine 0 C--N 1.322 -0.239 0 N-CA-C 110.993 -0.843 . . . . 50.0 110.993 -176.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.46 144.78 26.25 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.213 0.53 . . . . 50.0 112.023 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -131.7 154.28 81.76 Favored Pre-proline 0 C--N 1.322 -0.62 0 N-CA-C 108.638 -0.875 . . . . 50.0 108.638 -177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.11 137.59 37.74 Favored 'Trans proline' 0 C--N 1.351 0.663 0 N-CA-C 115.802 1.424 . . . . 50.0 115.802 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -83.51 159.2 61.88 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 125.121 1.368 . . . . 50.0 111.476 -178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.58 -24.8 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 N-CA-C 118.408 2.426 . . . . 50.0 118.408 -172.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -147.42 -44.41 0.17 Allowed 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.779 2.14 . . . . 50.0 116.779 -171.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -68.72 162.49 26.04 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 113.488 0.921 . . . . 50.0 113.488 -168.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -82.61 -34.54 27.59 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.233 0.827 . . . . 50.0 113.233 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.1 t -107.91 -21.71 12.73 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.426 1.639 . . . . 50.0 115.426 -170.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -82.56 164.03 21.11 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.342 -0.848 . . . . 50.0 112.706 -174.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -142.38 174.27 10.77 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 106.871 -1.529 . . . . 50.0 106.871 175.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -104.64 146.45 28.91 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 102.75 -3.056 . . . . 50.0 102.75 168.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.3 t -132.46 134.46 45.1 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.23 -1.396 . . . . 50.0 107.23 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.1 t -110.96 119.93 40.71 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 102.071 -3.307 . . . . 25.0 102.071 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.77 121.67 11.31 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.295 -0.631 . . . . 25.0 109.295 -175.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.36 31.23 18.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.057 0.943 . . . . 25.0 110.99 -176.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.55 8.43 84.06 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.149 -0.548 . . . . 25.0 113.689 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.72 151.43 30.26 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.642 -0.503 . . . . 50.0 109.642 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.29 132.27 34.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.976 -0.556 . . . . 50.0 111.343 -177.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -128.67 139.1 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.264 -1.754 . . . . 50.0 106.264 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -121.23 111.38 17.31 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.296 -2.113 . . . . 50.0 105.296 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.62 176.4 8.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.792 -0.818 . . . . 50.0 108.792 -171.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.5 p -124.28 156.38 37.02 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 115.477 1.658 . . . . 50.0 115.477 -174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -112.27 98.0 41.5 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.191 -1.411 . . . . 50.0 107.191 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.44 -91.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.302 0 N-CA-C 117.146 1.941 . . . . 50.0 117.146 -172.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -77.34 115.79 17.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 115.197 1.555 . . . . 25.0 115.197 -171.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 2.68 55.53 Favored Glycine 0 C--O 1.227 -0.312 0 N-CA-C 115.332 0.893 . . . . 25.0 115.332 172.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -105.1 134.66 47.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.108 0.454 . . . . 25.0 110.064 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -126.5 146.1 32.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 107.926 -1.139 . . . . 50.0 107.926 177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -81.9 132.64 35.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.376 -0.601 . . . . 50.0 109.376 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -118.89 109.33 15.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.014 0.912 . . . . 50.0 108.634 176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.99 -26.7 68.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.46 -0.791 . . . . 25.0 112.88 -176.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p -67.8 -29.76 69.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.542 0.571 . . . . 50.0 112.542 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 32.0 p -103.68 -5.3 22.72 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 121.425 -0.11 . . . . 25.0 111.225 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 54.66 39.44 31.26 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.682 -0.858 . . . . 50.0 108.682 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.6 p -146.88 168.77 20.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.57 -0.741 . . . . 25.0 110.299 -172.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 137.98 38.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.227 -1.768 . . . . 50.0 106.227 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -124.46 149.96 46.24 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.742 0.306 . . . . 25.0 110.201 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.8 t90 . . . . . 0 C--N 1.324 -0.53 0 N-CA-C 107.846 -1.168 . . . . 50.0 107.846 174.996 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.215 -0.725 0 CA-C-O 121.324 0.583 . . . . 25.0 110.502 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -55.69 -29.4 59.34 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.997 1.11 . . . . 50.0 113.997 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.2 t -112.31 -10.56 13.79 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.204 0.526 . . . . 25.0 112.396 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -72.68 126.68 30.47 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.327 -0.858 . . . . 50.0 109.376 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.04 2.1 84.04 Favored Glycine 0 C--O 1.225 -0.451 0 C-N-CA 121.302 -0.475 . . . . 25.0 113.004 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -101.03 147.56 26.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 O-C-N 122.264 -0.551 . . . . 50.0 111.839 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.13 161.47 26.87 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.872 -1.159 . . . . 25.0 107.872 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -72.32 179.8 3.25 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.228 0.537 . . . . 50.0 110.803 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.28 -176.63 24.55 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 112.046 -0.422 . . . . 50.0 112.046 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.404 ' CD2' ' HG ' ' A' ' 25' ' ' SER . 71.7 mt -96.76 145.76 25.52 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.006 0.432 . . . . 50.0 111.834 -179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.67 147.2 57.56 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 108.997 -0.742 . . . . 50.0 108.997 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.76 155.62 65.44 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 114.661 0.985 . . . . 50.0 114.661 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -95.24 153.81 39.61 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.129 0.972 . . . . 50.0 110.903 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.05 -26.57 10.7 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 117.149 -1.434 . . . . 50.0 115.711 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -163.76 -78.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.232 0.469 . . . . 50.0 111.258 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 38.62 -129.22 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.142 0.977 . . . . 50.0 112.297 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -136.43 -55.93 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.486 0.714 . . . . 50.0 110.152 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 m -156.56 47.4 0.45 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.161 0.43 . . . . 50.0 112.161 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -133.13 169.7 16.48 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 115.904 -0.589 . . . . 50.0 111.469 -174.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -153.64 174.34 14.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.978 -1.489 . . . . 75.0 106.978 -175.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -105.42 160.83 14.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.078 -1.082 . . . . 50.0 108.078 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.404 ' HG ' ' CD2' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -141.57 141.51 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.521 -0.918 . . . . 50.0 108.521 176.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.6 127.24 55.08 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 128.33 14.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.062 -1.459 . . . . 25.0 107.062 178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.34 30.67 10.58 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.095 0.776 . . . . 25.0 113.095 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.91 9.14 79.31 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.427 -0.416 . . . . 25.0 113.922 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -110.4 147.4 34.09 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.479 -0.934 . . . . 50.0 108.479 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -89.82 130.27 36.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.308 -0.86 . . . . 50.0 110.381 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -120.75 149.54 42.38 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.029 -2.582 . . . . 50.0 104.029 168.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -118.64 137.8 53.03 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 103.051 -2.944 . . . . 50.0 103.051 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -133.61 168.45 18.66 Favored 'General case' 0 CA--C 1.503 -0.863 0 O-C-N 123.293 0.37 . . . . 50.0 110.968 -173.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.0 p -136.9 159.1 42.86 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 102.145 -3.279 . . . . 50.0 102.145 170.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.1 m -123.17 78.54 52.26 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 104.091 -2.559 . . . . 50.0 104.091 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 -47.46 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 116.871 -1.619 . . . . 50.0 115.825 -167.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -100.95 116.21 32.26 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.055 1.131 . . . . 25.0 114.055 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.54 -11.44 6.99 Favored Glycine 0 N--CA 1.463 0.452 0 N-CA-C 118.791 2.277 . . . . 25.0 118.791 170.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.7 mt -120.79 152.66 38.08 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.44 1.12 . . . . 25.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.8 m -136.63 144.33 32.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.634 -0.876 . . . . 50.0 108.634 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -74.68 127.15 32.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.0 0.429 . . . . 50.0 110.927 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -112.88 111.49 22.29 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 122.033 0.92 . . . . 50.0 108.801 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -63.78 -21.97 66.68 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.781 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.2 p -67.95 -34.92 77.51 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.491 0.552 . . . . 50.0 112.491 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 3.1 p -104.28 -9.78 18.32 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 121.109 -0.236 . . . . 25.0 111.441 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 63.11 33.98 14.07 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.899 0.88 . . . . 50.0 110.591 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -142.83 166.68 23.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.642 -0.708 . . . . 25.0 109.26 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 m -86.8 146.83 26.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 106.735 -1.579 . . . . 50.0 106.735 169.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.17 160.7 27.27 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.2 t90 . . . . . 0 C--N 1.321 -0.65 0 N-CA-C 108.205 -1.035 . . . . 50.0 108.205 179.354 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.533 0.298 0 N-CA-C 113.33 0.863 . . . . 25.0 113.33 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -62.01 -41.47 98.1 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.747 -0.596 . . . . 50.0 112.465 -177.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.4 -12.0 9.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.576 0.703 . . . . 25.0 111.027 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.65 128.66 37.25 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 121.445 -0.785 . . . . 50.0 110.236 -177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.97 16.41 80.7 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 121.058 -0.592 . . . . 25.0 112.851 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -114.15 148.42 37.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 117.007 0.403 . . . . 50.0 110.647 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.15 150.81 47.11 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.472 -0.936 . . . . 25.0 108.472 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -68.77 164.66 21.31 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.357 0.598 . . . . 50.0 110.677 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.92 -175.13 16.0 Favored Glycine 0 CA--C 1.516 0.113 0 N-CA-C 110.306 -1.118 . . . . 50.0 110.306 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.1 mt -93.59 152.06 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.699 1.0 . . . . 50.0 113.699 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -133.68 148.79 69.95 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 106.892 -1.522 . . . . 50.0 106.892 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.98 145.5 35.82 Favored 'Trans proline' 0 C--N 1.349 0.555 0 N-CA-C 114.281 0.839 . . . . 50.0 114.281 -174.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -102.56 120.34 53.3 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 110.123 -0.325 . . . . 50.0 110.123 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.04 -18.1 14.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 116.31 -1.993 . . . . 50.0 113.808 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -70.34 -52.21 24.37 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 111.977 0.362 . . . . 50.0 111.977 -175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.81 141.07 52.17 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.363 -1.347 . . . . 50.0 107.363 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.26 -18.75 44.89 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.338 1.066 . . . . 50.0 108.326 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -77.71 -0.87 28.51 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.292 -1.777 . . . . 50.0 113.323 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 60.7 p -137.65 170.09 16.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.578 0.704 . . . . 50.0 112.172 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -143.52 172.56 12.62 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 50.0 108.741 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -107.79 152.8 23.88 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 102.959 -2.978 . . . . 50.0 102.959 171.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.7 t -140.02 142.75 36.22 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.137 -1.06 . . . . 50.0 108.137 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.49 128.91 56.47 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.682 -2.34 . . . . 25.0 104.682 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.55 113.72 6.94 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 107.234 -1.395 . . . . 25.0 107.234 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.35 34.86 24.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.786 0.834 . . . . 25.0 110.189 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.65 -1.49 57.7 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.691 0.636 . . . . 25.0 114.691 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -88.82 150.14 23.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.341 -0.985 . . . . 50.0 108.341 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.85 124.63 37.98 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 123.597 0.56 . . . . 50.0 109.821 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -118.99 136.5 54.07 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.275 -1.38 . . . . 50.0 107.275 172.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -117.28 118.36 32.05 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.564 -2.013 . . . . 50.0 105.564 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -142.06 157.92 44.35 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.158 0.435 . . . . 50.0 110.838 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.8 p -94.1 162.44 13.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.554 . . . . 50.0 109.886 177.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 44.9 t -114.62 122.63 33.59 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 107.258 -1.386 . . . . 50.0 107.258 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.62 -41.49 0.25 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 115.977 -2.215 . . . . 50.0 117.584 -173.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.1 m -103.66 117.32 34.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 115.653 1.723 . . . . 25.0 115.653 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.17 21.39 79.25 Favored Glycine 0 C--O 1.21 -1.404 0 C-N-CA 120.499 -0.857 . . . . 25.0 113.322 171.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.55 104.73 0.05 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 119.851 3.278 . . . . 25.0 119.851 -162.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -149.06 162.69 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 104.507 -2.405 . . . . 50.0 104.507 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -112.22 131.06 55.7 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.774 -0.579 . . . . 50.0 110.802 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 t -107.07 113.72 27.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.474 -0.565 . . . . 50.0 109.474 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.71 -35.32 79.36 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.657 0.614 . . . . 25.0 112.657 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.0 p -69.1 -33.14 73.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 120.769 0.319 . . . . 50.0 111.067 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 46.1 t -81.86 -22.13 37.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.672 -0.492 . . . . 25.0 109.672 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.2 tptt 59.97 26.86 16.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.684 -1.228 . . . . 50.0 107.684 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.0 p -142.03 167.86 21.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.273 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.47 138.06 35.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.912 -1.514 . . . . 50.0 106.912 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.0 p -131.39 168.01 18.32 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.905 -0.776 . . . . 25.0 108.905 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.6 m0 . . . . . 0 C--N 1.324 -0.525 0 N-CA-C 109.26 -0.645 . . . . 50.0 109.26 176.365 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 C--O 1.222 -0.349 0 CA-C-O 121.593 0.711 . . . . 25.0 111.824 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -63.01 -41.16 99.49 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.788 0.662 . . . . 50.0 112.788 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.8 t -95.99 -17.26 21.13 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.602 0.715 . . . . 25.0 111.007 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -68.16 132.39 47.1 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.069 -1.019 . . . . 50.0 109.071 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.44 12.81 79.83 Favored Glycine 0 C--O 1.226 -0.389 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.303 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -122.27 163.23 20.02 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.235 -1.395 . . . . 50.0 107.235 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.4 32.88 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 106.313 -1.736 . . . . 25.0 106.313 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.44 148.12 49.99 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.127 -1.064 . . . . 50.0 108.127 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.12 -177.28 23.66 Favored Glycine 0 C--O 1.237 0.315 0 N-CA-C 111.23 -0.748 . . . . 50.0 111.23 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.6 mt -96.46 139.75 32.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.146 0.498 . . . . 50.0 110.777 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -125.11 152.85 71.27 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 107.997 -1.112 . . . . 50.0 107.997 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.42 147.42 71.3 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 118.004 -0.864 . . . . 50.0 113.791 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -86.49 159.46 52.86 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 115.145 -0.934 . . . . 50.0 111.585 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -83.86 -20.19 4.6 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 118.032 2.282 . . . . 50.0 118.032 -172.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -146.01 -47.06 0.2 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.171 2.285 . . . . 50.0 117.171 -169.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -72.24 169.99 15.03 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.243 -0.435 . . . . 50.0 111.056 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -81.97 -50.49 9.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.192 1.182 . . . . 50.0 114.192 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 m -112.57 18.59 18.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 116.13 1.9 . . . . 50.0 116.13 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 86.9 p -102.07 165.46 11.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.173 0.442 . . . . 50.0 110.407 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -142.16 174.5 10.55 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.725 -0.843 . . . . 50.0 108.725 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -105.42 136.21 45.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 103.266 -2.865 . . . . 50.0 103.266 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -121.45 120.24 34.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.799 -1.185 . . . . 50.0 107.799 177.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.9 t -103.74 121.39 42.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 105.146 -2.168 . . . . 25.0 105.146 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -148.33 118.59 7.31 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.886 -0.413 . . . . 25.0 109.886 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.38 35.92 24.19 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.714 0.806 . . . . 25.0 112.335 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.01 3.38 84.58 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.071 -0.585 . . . . 25.0 113.639 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -104.74 150.8 24.45 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.053 -1.091 . . . . 50.0 108.053 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.7 tp -107.81 132.81 53.01 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.006 -0.739 . . . . 50.0 109.006 177.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -123.18 134.99 54.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 104.934 -2.247 . . . . 50.0 104.934 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -113.88 108.12 16.63 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 104.932 -2.247 . . . . 50.0 104.932 174.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -135.68 177.06 8.12 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.467 -0.938 . . . . 50.0 108.467 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -126.08 168.6 13.76 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.236 0.458 . . . . 50.0 112.236 -176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 81.2 m -100.19 98.23 7.37 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 105.739 -1.948 . . . . 50.0 105.739 171.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -84.98 -96.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 0 N-CA-C 116.002 1.501 . . . . 50.0 116.002 -172.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -73.78 114.89 12.57 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.187 -0.945 . . . . 25.0 113.402 -172.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.18 11.54 75.32 Favored Glycine 0 C--O 1.229 -0.209 0 CA-C-N 115.681 -0.691 . . . . 25.0 114.048 174.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 39.5 mt -124.95 153.73 42.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.48 0.64 . . . . 25.0 112.057 -173.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.0 m -139.23 161.66 28.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.021 -1.103 . . . . 50.0 108.021 177.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -93.21 132.75 37.09 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.007 -1.108 . . . . 50.0 108.007 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -111.24 101.91 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.249 0.547 . . . . 50.0 109.628 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.47 -19.09 64.44 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.704 1.001 . . . . 25.0 113.704 -175.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.436 ' HG ' ' H ' ' A' ' 46' ' ' CYS . 9.8 p -71.65 -52.09 19.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.969 -0.457 . . . . 50.0 111.302 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.436 ' H ' ' HG ' ' A' ' 45' ' ' SER . 21.8 p -101.09 -1.99 32.65 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.034 0.753 . . . . 25.0 113.034 -176.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.0 mptt 64.94 35.13 8.5 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.443 1.097 . . . . 50.0 108.457 177.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.6 m -105.58 157.21 17.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.233 -0.894 . . . . 25.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.1 t -103.26 121.64 43.13 Favored 'General case' 0 C--N 1.321 -0.652 1 N-CA-C 99.807 -4.146 . . . . 50.0 99.807 162.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -141.12 167.82 21.27 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -169.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 121.24 0.543 . . . . 50.0 111.916 -178.643 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 115.905 1.817 . . . . 25.0 115.905 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -60.33 -39.4 86.91 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.482 -0.761 . . . . 50.0 112.971 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.07 -0.57 15.61 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 112.515 0.561 . . . . 25.0 112.515 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.36 127.33 32.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 108.889 -0.782 . . . . 50.0 108.889 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.22 13.84 82.87 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 121.137 -0.554 . . . . 25.0 112.508 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -104.9 147.12 28.11 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.352 -0.981 . . . . 50.0 108.352 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.4 154.16 38.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 106.844 -1.539 . . . . 25.0 106.844 177.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.19 149.4 49.59 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.529 -0.915 . . . . 50.0 108.529 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.72 -175.1 20.46 Favored Glycine 0 C--O 1.234 0.105 0 N-CA-C 111.329 -0.708 . . . . 50.0 111.329 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.9 mt -97.93 147.49 24.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 50.0 112.286 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -128.49 147.64 64.83 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 107.729 -1.211 . . . . 50.0 107.729 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -73.57 150.77 46.21 Favored 'Trans proline' 0 C--N 1.346 0.421 0 N-CA-C 114.453 0.905 . . . . 50.0 114.453 -175.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -94.35 121.45 63.53 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.108 -1.071 . . . . 50.0 108.108 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.71 -18.82 21.89 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 116.262 -2.025 . . . . 50.0 113.718 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -88.66 -36.62 16.13 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 111.917 0.34 . . . . 50.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -116.09 149.45 38.94 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 114.328 1.233 . . . . 50.0 114.328 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -79.63 -58.07 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.88 -1.054 . . . . 50.0 112.037 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.8 m -98.0 21.56 10.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 116.124 1.898 . . . . 50.0 116.124 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 54.4 p -134.43 159.47 40.97 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.158 -0.682 . . . . 50.0 109.158 175.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -138.15 176.27 8.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.487 -0.778 . . . . 50.0 110.767 -172.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -107.85 144.93 34.37 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 104.116 -2.55 . . . . 50.0 104.116 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -130.13 140.2 50.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 106.18 -1.785 . . . . 50.0 106.18 178.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -120.69 133.05 55.38 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.507 -1.294 . . . . 25.0 107.507 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 109.48 4.47 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.3 36.39 26.96 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.645 0.736 . . . . 25.0 110.635 -177.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.29 -5.5 59.65 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 114.788 0.675 . . . . 25.0 114.788 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 mmt85 -84.15 148.93 26.51 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.251 -1.389 . . . . 50.0 107.251 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 131.46 52.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.963 -0.384 . . . . 50.0 109.963 -177.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -123.54 139.42 54.03 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 107.958 -1.126 . . . . 50.0 107.958 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -119.82 111.71 18.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.375 -1.713 . . . . 50.0 106.375 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -140.27 168.19 20.39 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.902 -0.407 . . . . 50.0 109.902 -173.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.1 p -112.2 159.5 18.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.088 0.774 . . . . 50.0 113.088 -176.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.86 90.12 50.2 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 105.434 -2.062 . . . . 50.0 105.434 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -79.79 -89.17 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 N-CA-C 117.053 1.905 . . . . 50.0 117.053 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.495 ' HG1' ' H ' ' A' ' 38' ' ' THR . 1.2 p -77.23 115.13 16.76 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.695 1.369 . . . . 25.0 114.695 -169.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 1.01 50.04 Favored Glycine 0 CA--C 1.519 0.304 0 N-CA-C 115.23 0.852 . . . . 25.0 115.23 174.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -103.71 134.31 47.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.795 0.331 . . . . 25.0 110.482 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.3 m -131.6 147.17 32.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.138 0.494 . . . . 50.0 110.12 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -80.61 135.83 36.13 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.629 -0.508 . . . . 50.0 109.629 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.6 t -109.45 101.54 10.49 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 107.866 -1.161 . . . . 50.0 107.866 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.37 -27.82 67.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.531 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 p -70.03 -41.26 74.48 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.224 0.453 . . . . 50.0 112.224 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.6 p -96.74 -10.47 26.75 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 -175.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mptt 66.4 31.11 8.45 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.183 0.993 . . . . 50.0 109.232 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.16 163.04 27.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.635 -0.711 . . . . 25.0 109.441 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.7 t -106.87 138.69 42.56 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 104.162 -2.533 . . . . 50.0 104.162 173.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -141.0 164.36 30.48 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.749 -0.463 . . . . 25.0 109.749 -174.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.2 t90 . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 107.667 -1.234 . . . . 50.0 107.667 175.711 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.8 p . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 121.286 0.565 . . . . 25.0 112.219 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -59.4 -33.49 71.28 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.914 0.709 . . . . 50.0 112.914 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 t -105.62 -11.38 16.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.287 0.565 . . . . 25.0 111.403 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -71.95 132.2 44.0 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 107.93 -1.137 . . . . 50.0 107.93 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.35 14.89 77.8 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.906 -0.664 . . . . 25.0 111.904 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -110.24 143.59 40.17 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.156 -0.683 . . . . 50.0 109.156 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.1 152.62 36.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 104.351 -2.463 . . . . 25.0 104.351 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -68.01 149.47 49.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.055 -0.72 . . . . 50.0 109.055 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.48 -176.11 21.61 Favored Glycine 0 N--CA 1.459 0.216 0 N-CA-C 110.88 -0.888 . . . . 50.0 110.88 -177.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.3 mt -94.71 145.51 24.8 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.88 0.84 . . . . 50.0 110.32 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -127.92 150.32 73.18 Favored Pre-proline 0 C--O 1.238 0.482 0 CA-C-N 116.496 -0.32 . . . . 50.0 111.245 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.49 148.97 74.13 Favored 'Trans proline' 0 C--N 1.352 0.724 0 N-CA-C 114.127 0.78 . . . . 50.0 114.127 -178.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.6 p-10 -102.71 150.54 37.8 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 114.869 -1.06 . . . . 50.0 111.448 -173.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.01 -30.0 7.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 N-CA-C 116.578 1.722 . . . . 50.0 116.578 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -78.34 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.931 0.787 . . . . 50.0 112.243 -176.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 34.43 -120.12 0.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.828 1.251 . . . . 50.0 113.262 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.6 tpt180 -155.82 -56.99 0.09 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.789 0.662 . . . . 50.0 112.789 177.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.1 m -153.68 39.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.723 -1.214 . . . . 50.0 107.723 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 p -137.93 157.27 46.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.489 -1.3 . . . . 50.0 107.489 -174.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.42 175.9 11.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.398 -0.819 . . . . 75.0 108.88 -167.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -98.56 154.32 18.0 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.615 -0.883 . . . . 50.0 108.615 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -139.81 131.85 27.9 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.425 -1.324 . . . . 50.0 107.425 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -110.28 134.33 52.36 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 106.144 -1.798 . . . . 25.0 106.144 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.09 126.89 11.79 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.36 31.35 14.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.545 0.738 . . . . 25.0 111.895 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.16 69.75 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 115.434 0.934 . . . . 25.0 115.434 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -112.26 149.96 31.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 118.218 1.009 . . . . 50.0 108.483 177.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.95 133.65 33.92 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.226 0.824 . . . . 50.0 113.226 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -117.33 146.64 43.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.463 -2.421 . . . . 50.0 104.463 165.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -117.23 131.58 56.82 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.562 -2.755 . . . . 50.0 103.562 169.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -136.88 169.41 17.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.6 0.593 . . . . 50.0 112.6 -168.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -136.31 157.79 45.96 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 101.082 -3.674 . . . . 50.0 101.082 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.8 m -106.45 108.3 61.57 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 103.9 -2.63 . . . . 50.0 103.9 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.35 -51.38 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.482 -1.878 . . . . 50.0 116.917 -164.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -105.75 114.47 28.65 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 115.663 1.727 . . . . 25.0 115.663 -172.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.69 4.04 37.55 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 117.66 1.824 . . . . 25.0 117.66 167.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -118.65 146.69 44.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.462 0.631 . . . . 25.0 111.117 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.07 151.04 33.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.069 -1.086 . . . . 50.0 108.069 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -80.32 118.89 22.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.343 0.592 . . . . 50.0 111.101 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.1 t -95.97 105.85 17.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.818 -1.179 . . . . 50.0 107.818 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -62.35 -28.88 70.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.528 0.566 . . . . 25.0 112.528 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -71.73 -33.48 68.75 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.936 -0.306 . . . . 50.0 111.148 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 51.9 t -84.6 -23.13 29.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 25.0 111.99 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 60.23 30.35 19.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 108.399 -0.963 . . . . 50.0 108.399 -170.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 10.4 p -143.3 165.04 28.58 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.241 -0.89 . . . . 25.0 108.851 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.45 136.47 33.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.706 -1.59 . . . . 50.0 106.706 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 34.0 p -121.16 158.9 26.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.201 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 . . . . . 0 C--N 1.324 -0.506 0 N-CA-C 107.861 -1.163 . . . . 50.0 107.861 178.381 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 122.024 0.916 . . . . 25.0 111.704 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.41 -40.69 71.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.513 -1.221 . . . . 50.0 111.684 173.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.4 t -114.02 -3.82 13.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.521 0.563 . . . . 25.0 112.521 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -63.29 117.68 6.95 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 120.534 -1.354 . . . . 50.0 109.473 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.95 17.39 78.5 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 116.556 -0.293 . . . . 25.0 113.669 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -91.89 145.41 24.57 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.755 -0.831 . . . . 50.0 108.755 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.37 148.51 51.53 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 106.862 -1.533 . . . . 25.0 106.862 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -68.24 144.25 54.97 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.975 -0.75 . . . . 50.0 108.975 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.63 -177.1 21.48 Favored Glycine 0 C--O 1.242 0.633 0 N-CA-C 109.765 -1.334 . . . . 50.0 109.765 -176.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.9 mt -96.66 151.8 19.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.264 1.03 . . . . 50.0 112.092 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -132.01 153.45 81.37 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 114.869 -1.059 . . . . 50.0 110.21 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.6 143.44 38.07 Favored 'Trans proline' 0 C--N 1.354 0.851 0 N-CA-C 116.11 1.542 . . . . 50.0 116.11 -174.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -88.73 158.61 47.69 Favored Pre-proline 0 CA--C 1.555 1.167 0 CA-C-N 114.877 -1.056 . . . . 50.0 111.539 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.62 -18.71 3.02 Favored 'Trans proline' 0 C--N 1.353 0.813 0 N-CA-C 118.927 2.626 . . . . 50.0 118.927 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -133.95 -59.77 0.83 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 117.124 2.268 . . . . 50.0 117.124 -172.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -70.38 161.46 30.43 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 114.463 1.283 . . . . 50.0 114.463 -167.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -64.81 -41.97 95.38 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 115.654 1.724 . . . . 50.0 115.654 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.9 m -129.34 3.35 5.14 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.118 1.895 . . . . 50.0 116.118 -173.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.4 p -77.71 165.29 24.41 Favored 'General case' 0 C--O 1.212 -0.874 0 O-C-N 121.208 -0.933 . . . . 50.0 110.122 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -148.89 168.69 22.34 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.214 1.007 . . . . 50.0 111.107 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -100.98 153.92 19.12 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.882 -2.636 . . . . 50.0 103.882 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.9 t -140.63 149.07 41.83 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 106.785 -1.561 . . . . 50.0 106.785 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m -123.79 129.38 50.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 105.612 -1.995 . . . . 25.0 105.612 176.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.2 119.54 14.74 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.283 -1.006 . . . . 25.0 108.283 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.39 35.38 17.22 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 123.45 0.7 . . . . 25.0 111.965 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.88 14.38 78.47 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.578 0.591 . . . . 25.0 114.578 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -109.48 143.96 38.39 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.035 -1.098 . . . . 50.0 108.035 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.57 137.7 37.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.765 0.793 . . . . 50.0 112.684 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -128.95 136.16 49.99 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 106.355 -1.72 . . . . 50.0 106.355 166.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -125.09 113.0 17.16 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 103.891 -2.633 . . . . 50.0 103.891 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -137.14 162.58 33.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.082 0.467 . . . . 50.0 111.418 -170.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -108.36 149.85 28.13 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.162 -0.681 . . . . 50.0 109.162 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.04 120.98 47.17 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 103.322 -2.844 . . . . 50.0 103.322 175.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.45 -84.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 N-CA-C 118.19 2.342 . . . . 50.0 118.19 -165.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.3 m -97.53 114.96 26.95 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.896 1.813 . . . . 25.0 115.896 -169.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.74 26.37 69.6 Favored Glycine 0 C--O 1.221 -0.673 0 N-CA-C 116.436 1.335 . . . . 25.0 116.436 170.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.64 161.97 17.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.083 0.942 . . . . 25.0 111.311 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -138.83 171.35 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 106.583 -1.636 . . . . 50.0 106.583 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -101.69 137.5 39.92 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.921 0.782 . . . . 50.0 110.007 177.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.9 t -116.82 108.17 15.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 122.129 0.966 . . . . 50.0 111.076 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -65.41 -24.28 67.16 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 113.112 0.782 . . . . 25.0 113.112 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -66.61 -40.32 88.76 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.137 -0.352 . . . . 50.0 111.07 -176.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 p -103.89 -7.83 20.16 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.595 -0.442 . . . . 25.0 111.8 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm 62.56 35.45 14.45 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.659 0.783 . . . . 50.0 110.266 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.54 160.75 28.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.49 0.662 . . . . 25.0 110.635 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 43.8 t -86.27 128.2 34.88 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.122 -3.288 . . . . 50.0 102.122 168.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.7 p -126.92 163.97 22.48 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 122.581 0.352 . . . . 25.0 111.363 -172.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t90 . . . . . 0 C--N 1.327 -0.413 0 CA-C-O 120.895 0.379 . . . . 50.0 111.636 -179.419 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 121.797 0.808 . . . . 25.0 109.806 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.71 -36.71 70.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.083 -0.962 . . . . 50.0 111.912 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.72 -0.99 21.42 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.853 0.686 . . . . 25.0 112.853 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -74.53 128.64 36.06 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 121.612 -0.68 . . . . 50.0 109.302 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 76.59 22.18 73.17 Favored Glycine 0 C--O 1.227 -0.288 0 C-N-CA 120.964 -0.636 . . . . 25.0 112.881 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -113.44 148.15 36.46 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.892 -0.781 . . . . 50.0 108.892 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.72 31.02 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.39 142.83 56.6 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.877 -0.786 . . . . 50.0 108.877 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.75 -174.22 22.76 Favored Glycine 0 C--O 1.229 -0.156 0 C-N-CA 121.21 -0.519 . . . . 50.0 113.122 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -96.67 148.83 22.47 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.593 0.357 . . . . 50.0 110.332 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -131.08 148.19 69.28 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-N 116.028 -0.533 . . . . 50.0 111.381 -176.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.12 147.45 60.6 Favored 'Trans proline' 0 C--N 1.351 0.708 0 N-CA-C 113.656 0.599 . . . . 50.0 113.656 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -121.89 150.81 56.77 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 114.965 -1.016 . . . . 50.0 111.259 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -86.12 -18.85 3.34 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 N-CA-C 117.712 2.158 . . . . 50.0 117.712 -174.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -117.16 -58.62 2.04 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 116.453 2.02 . . . . 50.0 116.453 -168.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.557 ' HB3' ' HG ' ' A' ' 22' ' ' SER . 38.4 mp0 -68.3 150.17 48.55 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.202 0.525 . . . . 50.0 111.865 -173.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.16 -65.39 1.02 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-O 121.505 0.669 . . . . 50.0 111.555 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -95.32 24.56 4.96 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.565 0.95 . . . . 50.0 113.565 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.557 ' HG ' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -145.06 162.04 37.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.525 -1.287 . . . . 50.0 107.525 179.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.6 -177.85 6.63 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.298 -1.001 . . . . 75.0 108.298 -163.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -101.82 156.84 17.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.59 -1.633 . . . . 50.0 106.59 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.0 t -143.75 145.6 32.51 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 107.826 -1.176 . . . . 50.0 107.826 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 t -131.73 130.88 42.51 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.25 -1.019 . . . . 25.0 108.25 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.13 123.22 12.11 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.178 -1.045 . . . . 25.0 108.178 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.48 34.39 18.21 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.61 0.764 . . . . 25.0 112.444 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.59 13.35 82.03 Favored Glycine 0 C--O 1.237 0.342 0 C-N-CA 121.217 -0.516 . . . . 25.0 113.862 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -108.26 140.12 41.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.767 -1.198 . . . . 50.0 107.767 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 41.5 tp -87.77 128.65 35.32 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.315 0.384 . . . . 50.0 110.262 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -122.02 140.78 52.08 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 104.421 -2.437 . . . . 50.0 104.421 169.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -114.0 122.15 46.04 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 102.989 -2.967 . . . . 50.0 102.989 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -136.42 164.56 27.87 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 113.739 1.014 . . . . 50.0 113.739 -166.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.3 p -123.37 160.83 25.94 Favored 'General case' 0 C--N 1.32 -0.7 1 N-CA-C 100.191 -4.003 . . . . 50.0 100.191 164.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -101.55 123.5 44.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 106.021 -1.844 . . . . 50.0 106.021 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.43 -55.43 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 115.435 -2.576 . . . . 50.0 116.492 -170.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.58 85.0 6.6 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 115.389 1.625 . . . . 25.0 115.389 -174.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.53 -9.51 0.85 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 118.284 2.073 . . . . 25.0 118.284 168.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 31.6 mt -81.07 155.92 26.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 118.163 0.981 . . . . 25.0 113.11 -166.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.4 m -124.14 151.82 29.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 107.449 -1.315 . . . . 50.0 107.449 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -75.25 126.64 31.44 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.404 -0.81 . . . . 50.0 109.334 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.4 t -109.94 109.49 20.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.403 -0.962 . . . . 50.0 108.403 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.83 -14.01 60.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.723 1.008 . . . . 25.0 113.723 -176.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.5 p -71.48 -47.86 52.89 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.299 -0.876 . . . . 50.0 110.249 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.2 p -92.78 -6.66 48.48 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.772 1.027 . . . . 25.0 113.772 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 59.94 35.16 21.65 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.108 -1.441 . . . . 50.0 107.108 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -142.91 168.03 20.67 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.584 -0.734 . . . . 25.0 110.389 -172.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.73 131.27 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.101 -1.074 . . . . 50.0 108.101 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.86 152.96 43.32 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.699 0.285 . . . . 25.0 110.369 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.0 t90 . . . . . 0 C--N 1.323 -0.583 0 N-CA-C 107.35 -1.352 . . . . 50.0 107.35 174.36 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 C--O 1.222 -0.355 0 CA-C-O 121.881 0.848 . . . . 25.0 109.985 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -56.27 -31.34 63.51 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.302 -0.863 . . . . 50.0 111.384 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.6 t -110.98 -16.28 13.56 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.475 0.917 . . . . 25.0 113.475 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.81 126.14 28.09 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 119.297 -0.961 . . . . 50.0 108.498 177.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 10.88 72.34 Favored Glycine 0 CA--C 1.521 0.454 0 CA-C-N 115.544 -0.753 . . . . 25.0 113.544 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -106.91 149.39 27.51 Favored 'General case' 0 CA--C 1.504 -0.813 0 O-C-N 121.448 -1.03 . . . . 50.0 108.392 178.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.48 151.43 41.05 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 105.83 -1.915 . . . . 25.0 105.83 176.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.78 150.36 49.23 Favored 'General case' 0 C--O 1.246 0.904 0 N-CA-C 107.578 -1.268 . . . . 50.0 107.578 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.0 179.59 19.13 Favored Glycine 0 C--O 1.242 0.612 0 N-CA-C 110.097 -1.201 . . . . 50.0 110.097 -175.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.2 mt -101.33 149.44 24.03 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 112.865 0.691 . . . . 50.0 112.865 -177.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -132.79 144.12 51.57 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 107.622 -1.251 . . . . 50.0 107.622 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.16 149.19 45.59 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 117.32 -1.32 . . . . 50.0 114.249 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -96.3 118.27 65.58 Favored Pre-proline 0 C--O 1.216 -0.702 0 N-CA-C 108.586 -0.894 . . . . 50.0 108.586 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -79.92 -13.18 13.04 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 115.415 1.275 . . . . 50.0 115.415 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -87.41 -42.73 12.62 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.151 0.501 . . . . 50.0 111.167 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -97.94 155.32 17.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.16 -0.927 . . . . 50.0 112.689 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -69.2 -46.85 66.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.521 1.674 . . . . 50.0 115.521 -177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -130.44 20.75 5.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.742 1.756 . . . . 50.0 115.742 -167.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 63.1 p -111.01 164.15 13.11 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.122 -1.066 . . . . 50.0 108.122 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -135.13 166.58 22.75 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 122.128 0.966 . . . . 50.0 108.591 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -97.6 145.78 25.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 101.209 -3.626 . . . . 50.0 101.209 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -135.76 138.44 42.66 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.396 -1.335 . . . . 50.0 107.396 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.4 m -114.13 123.95 50.88 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.825 -0.805 . . . . 25.0 108.825 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.98 113.62 13.62 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.81 38.54 26.88 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.913 0.758 . . . . 25.0 109.383 -177.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.36 15.2 74.85 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 115.565 0.986 . . . . 25.0 115.565 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -113.57 149.18 34.85 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.694 -0.854 . . . . 50.0 108.694 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -93.3 130.44 39.03 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 113.674 0.99 . . . . 50.0 113.674 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.97 137.83 53.23 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 106.916 -1.513 . . . . 50.0 106.916 169.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -117.65 108.98 16.09 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 105.332 -2.099 . . . . 50.0 105.332 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.73 165.4 27.39 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.188 -0.32 . . . . 50.0 110.786 -168.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.82 164.11 11.82 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.849 0.833 . . . . 50.0 111.623 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.18 95.8 38.2 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 104.5 -2.407 . . . . 50.0 104.5 167.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -91.83 -119.13 0.01 OUTLIER 'Trans proline' 0 C--O 1.25 1.12 0 C-N-CA 120.435 0.757 . . . . 50.0 113.211 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.445 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.9 OUTLIER -64.49 142.61 58.36 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 121.115 -0.99 . . . . 25.0 112.185 -178.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 79.27 -7.6 51.67 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 116.947 1.539 . . . . 25.0 116.947 173.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.6 mt -131.83 142.69 49.79 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.146 0.973 . . . . 25.0 111.773 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.8 149.71 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 108.395 -0.965 . . . . 50.0 108.395 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -90.1 132.39 35.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.657 0.742 . . . . 50.0 112.631 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.8 t -113.32 102.64 10.54 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 121.726 0.774 . . . . 50.0 109.737 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -63.74 -27.75 69.41 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 114.385 1.254 . . . . 25.0 114.385 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 p -67.7 -35.67 79.23 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.053 0.39 . . . . 50.0 112.053 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.3 p -104.83 -7.82 19.16 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.079 0.4 . . . . 25.0 112.079 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm 59.43 44.76 14.57 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.087 1.355 . . . . 50.0 113.069 -174.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.02 168.08 16.56 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.02 -0.991 . . . . 25.0 110.998 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.23 132.3 53.22 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 103.119 -2.919 . . . . 50.0 103.119 168.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 77.1 p -118.69 158.5 25.39 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.76 0.791 . . . . 25.0 111.314 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 115.098 -0.955 . . . . 50.0 109.354 178.654 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.6 p . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 114.136 1.161 . . . . 25.0 114.136 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -64.53 -45.42 87.23 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 113.959 1.096 . . . . 50.0 113.959 -173.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.34 -7.31 13.98 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.563 0.697 . . . . 25.0 111.979 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -70.85 122.51 20.05 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 116.154 -0.476 . . . . 50.0 109.83 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.32 19.95 68.01 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.173 -0.537 . . . . 25.0 113.041 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -119.48 149.86 41.19 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 117.171 0.486 . . . . 50.0 111.097 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 153.27 42.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.245 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -70.45 148.41 48.35 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.652 -0.704 . . . . 50.0 110.353 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.23 -179.41 23.26 Favored Glycine 0 CA--C 1.517 0.169 0 N-CA-C 109.942 -1.263 . . . . 50.0 109.942 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -98.75 143.93 28.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.286 1.043 . . . . 50.0 111.108 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.98 148.2 61.95 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.665 -0.495 . . . . 50.0 109.665 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.35 148.86 55.84 Favored 'Trans proline' 0 C--N 1.35 0.614 0 N-CA-C 115.249 1.211 . . . . 50.0 115.249 -175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -84.07 154.77 64.05 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-N 114.408 -1.269 . . . . 50.0 110.38 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -81.48 -21.15 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 N-CA-C 115.981 1.493 . . . . 50.0 115.981 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 -29.67 0.49 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.3 1.593 . . . . 50.0 115.3 -169.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -74.47 -178.51 3.56 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 124.482 1.113 . . . . 50.0 112.349 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -134.96 -56.05 0.82 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.498 -0.751 . . . . 50.0 111.549 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -79.87 -2.84 45.36 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.268 0.84 . . . . 50.0 113.268 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.5 p -130.36 154.58 47.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.437 . . . . 50.0 110.529 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -177.93 6.07 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.279 -1.008 . . . . 75.0 108.279 -170.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -106.04 158.87 16.49 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.973 -1.491 . . . . 50.0 106.973 176.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.1 t -142.73 153.41 43.3 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.091 -1.448 . . . . 50.0 107.091 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.46 128.29 46.73 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 104.46 -2.422 . . . . 25.0 104.46 175.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.85 118.76 11.81 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.97 -1.493 . . . . 25.0 106.97 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.71 33.72 21.91 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.801 0.84 . . . . 25.0 110.352 -173.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.15 7.94 68.46 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 114.619 0.608 . . . . 25.0 114.619 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -101.46 153.26 19.86 Favored 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 121.863 -0.786 . . . . 50.0 108.98 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.98 128.8 33.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.153 -0.476 . . . . 50.0 110.144 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.33 149.52 52.34 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.264 -2.495 . . . . 50.0 104.264 169.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -113.97 146.18 40.49 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 103.125 -2.917 . . . . 50.0 103.125 171.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -129.16 164.7 22.81 Favored 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 109.144 -0.687 . . . . 50.0 109.144 -171.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.0 p -146.58 155.03 42.18 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 102.022 -3.325 . . . . 50.0 102.022 171.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -116.76 117.55 37.52 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 103.086 -2.931 . . . . 50.0 103.086 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.86 -87.6 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 117.528 -1.181 . . . . 50.0 114.676 -171.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.4 t -104.07 153.11 21.27 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.565 -0.709 . . . . 25.0 110.874 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -10.48 4.71 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 118.968 2.347 . . . . 25.0 118.968 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -129.31 144.77 51.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 118.09 0.945 . . . . 25.0 109.439 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.9 m -135.47 147.19 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 109.508 -0.553 . . . . 50.0 109.508 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -77.55 130.34 36.81 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.392 -0.818 . . . . 50.0 109.662 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -126.49 122.73 36.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.49 0.662 . . . . 50.0 109.638 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -64.31 -21.72 66.7 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.4 p -67.67 -32.25 72.78 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.784 0.265 . . . . 50.0 111.467 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.9 t -94.11 -21.75 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.438 -0.578 . . . . 25.0 109.438 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.3 tptt 60.32 26.85 16.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.982 -1.008 . . . . 50.0 108.46 -171.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -143.26 171.69 13.76 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.286 -1.324 . . . . 25.0 107.663 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.3 t -88.25 127.06 35.45 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.433 -1.691 . . . . 50.0 106.433 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 41.8 p -112.67 161.52 16.76 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.409 -0.589 . . . . 25.0 109.409 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.6 t90 . . . . . 0 C--N 1.323 -0.583 0 N-CA-C 109.34 -0.615 . . . . 50.0 109.34 177.158 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.9 p . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 121.263 0.554 . . . . 25.0 111.447 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -58.35 -39.48 79.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.092 0.775 . . . . 50.0 113.092 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.06 2.34 16.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.916 0.71 . . . . 25.0 112.916 -177.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -69.66 123.9 22.58 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.452 -0.573 . . . . 50.0 109.452 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.65 17.93 78.35 Favored Glycine 0 C--O 1.226 -0.37 0 C-N-CA 121.216 -0.516 . . . . 25.0 113.706 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -102.23 145.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-N 117.66 0.73 . . . . 50.0 109.995 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 152.35 44.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.857 -1.065 . . . . 25.0 108.868 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.66 160.39 22.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.667 -0.697 . . . . 50.0 111.899 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.11 -176.55 16.21 Favored Glycine 0 N--CA 1.458 0.143 0 CA-C-N 116.046 -0.525 . . . . 50.0 111.966 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -96.33 151.88 19.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.48 0.657 . . . . 50.0 111.539 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -132.64 147.31 65.04 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 106.094 -1.817 . . . . 50.0 106.094 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.61 146.38 49.09 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 117.368 -1.288 . . . . 50.0 113.528 -175.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -107.59 124.19 35.75 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 116.43 -0.35 . . . . 50.0 110.147 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.71 -15.96 8.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 116.234 1.59 . . . . 50.0 116.234 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -123.24 -47.03 2.03 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 119.554 3.168 . . . . 50.0 119.554 -170.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.36 -65.76 0.51 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 116.273 1.953 . . . . 50.0 116.273 -164.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -172.47 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.985 -0.746 . . . . 50.0 108.985 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.3 p -118.36 14.98 13.88 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.286 -1.746 . . . . 50.0 106.286 175.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 114.251 -1.34 . . . . 50.0 110.374 -178.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -133.32 -179.46 5.52 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.978 -1.119 . . . . 50.0 107.978 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -107.86 145.17 34.05 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.621 -3.103 . . . . 50.0 102.621 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -134.33 143.14 47.51 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 106.609 -1.626 . . . . 50.0 106.609 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.91 127.7 52.1 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 177.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.17 120.59 14.98 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.72 32.25 17.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.645 0.778 . . . . 25.0 111.855 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.2 79.77 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 121.119 -0.562 . . . . 25.0 113.669 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -118.62 148.36 42.79 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.678 -1.23 . . . . 50.0 107.678 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 51.4 tp -91.41 129.17 37.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.53 0.566 . . . . 50.0 112.53 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -120.72 132.56 55.14 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.429 -1.693 . . . . 50.0 106.429 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -113.98 107.34 15.54 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 104.309 -2.478 . . . . 50.0 104.309 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -143.51 169.62 17.36 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.788 -0.449 . . . . 50.0 109.788 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.6 p -117.42 160.07 21.77 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.274 -0.639 . . . . 50.0 109.274 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.53 127.68 55.7 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 107.371 -1.344 . . . . 50.0 107.371 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.83 -55.68 0.25 Allowed 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 116.091 -2.139 . . . . 50.0 117.028 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.677 ' HG1' ' HE1' ' A' ' 51' ' ' TRP . 10.7 t -106.31 143.75 33.99 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.709 -0.619 . . . . 25.0 112.275 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.08 14.39 70.93 Favored Glycine 0 C--O 1.222 -0.597 0 N-CA-C 115.909 1.124 . . . . 25.0 115.909 169.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.3 111.6 0.6 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 118.945 2.943 . . . . 25.0 118.945 -160.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.3 m -145.62 161.49 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 N-CA-C 104.569 -2.382 . . . . 50.0 104.569 165.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -116.05 130.03 56.63 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.678 -0.49 . . . . 50.0 109.678 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.2 t -110.17 114.22 27.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.843 0.83 . . . . 50.0 109.812 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -63.01 -31.35 72.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.386 -0.824 . . . . 25.0 113.118 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 44.4 p -65.57 -32.07 73.46 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.294 0.85 . . . . 50.0 113.294 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 28.3 p -104.51 -5.38 21.62 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.39 -0.226 . . . . 25.0 110.39 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? 52.3 41.25 30.37 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.468 -0.938 . . . . 50.0 108.468 -173.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.4 p -143.15 168.37 19.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.613 -0.722 . . . . 25.0 111.417 -172.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.3 t -86.21 139.93 30.61 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.061 -1.459 . . . . 50.0 107.061 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.9 p -128.02 167.84 16.14 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 105.497 -2.038 . . . . 25.0 105.497 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.677 ' HE1' ' HG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 N-CA-C 106.243 -1.762 . . . . 50.0 106.243 174.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 121.228 0.537 . . . . 25.0 112.055 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.466 ' CD1' HD12 ' A' ' 31' ' ' LEU . 77.1 t80 -64.91 -28.85 69.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.353 -0.385 . . . . 50.0 111.913 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -111.31 10.11 21.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.625 -0.262 . . . . 25.0 111.529 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -73.69 138.8 44.93 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.599 -0.889 . . . . 50.0 108.599 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 71.65 17.58 76.65 Favored Glycine 0 C--O 1.227 -0.31 0 C-N-CA 121.027 -0.606 . . . . 25.0 112.733 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -126.33 147.72 49.68 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.125 -0.695 . . . . 50.0 109.125 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.17 156.56 35.76 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -69.94 148.07 49.41 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.744 -1.206 . . . . 50.0 107.744 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.04 -174.39 24.41 Favored Glycine 0 N--CA 1.454 -0.124 0 N-CA-C 110.243 -1.143 . . . . 50.0 110.243 -175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.2 mt -97.64 148.85 22.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.427 0.614 . . . . 50.0 111.347 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -132.13 154.51 81.69 Favored Pre-proline 0 C--O 1.24 0.568 0 N-CA-C 112.111 0.412 . . . . 50.0 112.111 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.07 131.1 27.55 Favored 'Trans proline' 0 C--N 1.357 0.984 0 N-CA-C 114.346 0.864 . . . . 50.0 114.346 -177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.524 ' ND2' ' HG ' ' A' ' 22' ' ' SER . 15.8 p-10 -118.8 150.69 48.92 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 114.541 -1.209 . . . . 50.0 111.562 -172.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.65 -19.44 4.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 N-CA-C 117.3 2.0 . . . . 50.0 117.3 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -79.49 -59.85 2.59 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 116.235 1.939 . . . . 50.0 116.235 -166.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.91 151.24 40.8 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.252 0.464 . . . . 50.0 112.252 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -60.45 -33.2 72.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.766 0.826 . . . . 50.0 111.142 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.449 ' H ' ' HG ' ' A' ' 21' ' ' SER . 40.3 p -85.69 -0.34 54.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.769 -1.105 . . . . 50.0 113.684 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.524 ' HG ' ' ND2' ' A' ' 16' ' ' ASN . 91.2 p -122.46 167.54 13.21 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.437 -0.949 . . . . 50.0 108.437 -178.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -154.83 173.89 15.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.409 0.623 . . . . 50.0 111.764 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -102.83 145.29 29.99 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 102.343 -3.206 . . . . 50.0 102.343 169.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.2 t -135.72 141.62 44.92 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.834 -1.173 . . . . 50.0 107.834 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.2 m -117.11 127.54 54.24 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 105.732 -1.951 . . . . 25.0 105.732 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.68 128.52 23.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.835 -1.913 . . . . 25.0 105.835 177.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.29 28.54 13.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.986 0.914 . . . . 25.0 110.578 -173.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 69.17 23.37 76.23 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 121.202 -0.523 . . . . 25.0 113.799 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.1 mmt-85 -123.82 149.37 45.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 117.855 0.827 . . . . 50.0 109.013 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.466 HD12 ' CD1' ' A' ' 5' ' ' PHE . 51.2 tp -79.42 127.9 32.68 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 114.046 1.128 . . . . 50.0 114.046 -177.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -123.86 131.96 53.67 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.861 -1.903 . . . . 50.0 105.861 167.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -113.98 124.31 51.85 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.202 -1.777 . . . . 50.0 106.202 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -143.49 170.94 14.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.024 -0.361 . . . . 50.0 110.024 -172.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.8 p -121.31 162.79 19.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.321 -0.992 . . . . 50.0 108.321 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.5 t -123.14 71.53 44.4 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 106.474 -1.676 . . . . 50.0 106.474 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.27 -27.71 9.36 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 116.201 -2.066 . . . . 50.0 117.277 -164.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.467 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -80.07 86.41 5.53 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.505 1.298 . . . . 25.0 114.505 -175.021 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.98 2.14 29.31 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.312 2.085 . . . . 25.0 118.312 168.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.0 mt -122.69 162.87 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.215 1.007 . . . . 25.0 111.158 -173.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.31 159.82 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.457 -0.338 . . . . 50.0 110.66 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.78 125.89 29.15 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.258 -0.577 . . . . 50.0 110.351 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -107.2 109.72 21.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.862 0.839 . . . . 50.0 109.226 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.29 -20.55 66.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.11 1.152 . . . . 25.0 114.11 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.6 p -70.75 -43.65 68.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.545 0.572 . . . . 50.0 112.545 -177.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 13.9 p -104.5 -6.96 20.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.93 0.344 . . . . 25.0 111.93 -177.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 61.66 39.32 14.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.857 0.863 . . . . 50.0 110.928 -176.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.96 169.14 13.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.577 -0.738 . . . . 25.0 109.505 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.5 t -99.16 122.89 42.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 105.564 -2.013 . . . . 50.0 105.564 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -146.24 173.67 12.02 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.062 0.145 . . . . 25.0 110.676 -173.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 . . . . . 0 N--CA 1.468 0.439 0 CA-C-O 120.94 0.4 . . . . 50.0 111.569 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 114.234 1.198 . . . . 25.0 114.234 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.27 -37.32 86.82 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 125.02 1.328 . . . . 50.0 114.008 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -104.34 -1.98 26.16 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 118.437 0.562 . . . . 25.0 111.429 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -74.73 127.17 32.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.645 1.212 . . . . 50.0 108.661 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.9 -8.35 70.26 Favored Glycine 0 CA--C 1.546 2.006 0 CA-C-N 113.959 -1.473 . . . . 25.0 113.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -88.44 146.51 25.18 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 122.107 -0.643 . . . . 50.0 110.842 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.97 154.73 35.63 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.074 -1.084 . . . . 25.0 108.074 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -63.5 148.11 49.56 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 109.906 -0.405 . . . . 50.0 109.906 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.36 -169.64 25.37 Favored Glycine 0 C--O 1.211 -1.3 0 N-CA-C 110.485 -1.046 . . . . 50.0 110.485 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.5 mt -115.37 138.19 51.25 Favored 'General case' 0 CA--C 1.488 -1.44 0 O-C-N 120.502 -1.587 . . . . 50.0 110.835 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -124.99 146.45 53.55 Favored Pre-proline 0 C--O 1.218 -0.567 0 C-N-CA 125.198 1.399 . . . . 50.0 108.317 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 151.21 40.96 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 115.998 -2.201 . . . . 50.0 113.901 -171.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -87.37 138.07 32.28 Favored Pre-proline 0 CA--C 1.556 1.21 0 N-CA-C 109.1 -0.704 . . . . 50.0 109.1 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -79.41 -19.79 10.04 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 N-CA-C 116.107 1.541 . . . . 50.0 116.107 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -102.14 -42.38 6.08 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.941 -0.474 . . . . 50.0 111.816 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -106.44 162.16 13.95 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.9 -0.778 . . . . 50.0 108.9 173.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.52 -8.05 10.53 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 116.484 2.031 . . . . 50.0 116.484 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.23 10.36 31.83 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 107.849 -1.167 . . . . 50.0 107.849 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.7 p -121.75 167.31 13.12 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 107.867 -1.16 . . . . 50.0 107.867 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -146.72 169.95 17.98 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.099 -0.955 . . . . 50.0 109.657 -175.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.23 133.86 42.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 104.302 -2.481 . . . . 50.0 104.302 164.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -112.71 135.69 53.16 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.21 -2.145 . . . . 50.0 105.21 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -116.09 125.04 51.85 Favored 'General case' 0 C--O 1.246 0.873 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 174.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.7 124.86 16.37 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 124.243 0.965 . . . . 25.0 108.988 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 51.63 37.1 19.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.021 0.915 . . . . 25.0 111.186 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.37 7.73 64.58 Favored Glycine 0 CA--C 1.543 1.823 0 CA-C-N 115.12 -0.946 . . . . 25.0 115.156 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -108.56 150.67 27.16 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 120.805 -1.409 . . . . 50.0 108.325 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.89 133.88 36.84 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.558 1.318 . . . . 50.0 114.558 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -124.76 149.23 47.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 105.715 -1.957 . . . . 50.0 105.715 171.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -129.13 105.95 8.52 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.803 -1.185 . . . . 50.0 108.09 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.97 175.23 9.73 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 112.743 0.645 . . . . 50.0 112.743 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.7 p -113.08 163.31 14.88 Favored 'General case' 0 C--O 1.206 -1.191 0 O-C-N 123.682 0.614 . . . . 50.0 111.708 177.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.2 88.69 37.96 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 102.136 -3.283 . . . . 50.0 102.136 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -85.09 -66.27 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.139 0 N-CA-C 120.638 3.284 . . . . 50.0 120.638 -167.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.491 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.8 OUTLIER -86.54 117.81 25.55 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.045 -1.659 . . . . 25.0 112.703 -170.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.24 17.91 79.66 Favored Glycine 0 CA--C 1.55 2.273 0 CA-C-O 117.658 -1.634 . . . . 25.0 113.271 174.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 71.1 mt -138.13 153.19 49.26 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 114.785 1.402 . . . . 25.0 114.785 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.82 166.96 18.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 N-CA-C 107.545 -1.28 . . . . 50.0 107.545 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -101.4 129.7 47.47 Favored 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 116.236 -0.438 . . . . 50.0 110.762 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.6 t -119.92 112.01 18.66 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 123.222 1.487 . . . . 50.0 109.895 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.02 -23.88 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.935 -1.029 . . . . 25.0 112.455 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.2 p -68.52 -29.89 68.58 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 118.964 -0.541 . . . . 50.0 111.583 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.37 -6.72 22.71 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.5 tptt 59.29 33.65 22.63 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 123.124 1.44 . . . . 50.0 108.963 -177.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 2.6 p -145.89 167.49 23.14 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 113.647 -1.615 . . . . 25.0 113.935 -170.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.1 t -85.79 136.31 33.37 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 115.15 -0.932 . . . . 50.0 109.377 175.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.9 p -131.39 170.64 14.38 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.355 -0.98 . . . . 25.0 108.355 -175.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 . . . . . 0 C--O 1.207 -1.157 0 C-N-CA 124.129 0.972 . . . . 50.0 112.423 179.697 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.415 0 CA-C-O 119.036 -0.869 . . . . 25.0 111.408 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.6 p -76.49 154.43 83.82 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 118.368 1.084 . . . . 25.0 108.428 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.99 134.65 25.84 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 117.216 -1.39 . . . . 25.0 112.956 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 p -105.06 10.51 33.98 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.632 0.604 . . . . 25.0 112.632 -174.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -54.5 -37.61 65.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.054 1.501 . . . . 50.0 115.054 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.44 3.88 15.1 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.939 0.4 . . . . 25.0 112.05 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.56 122.09 19.88 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.631 -0.668 . . . . 50.0 109.812 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.64 -1.45 82.84 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 121.078 -0.582 . . . . 25.0 113.643 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -82.52 143.9 30.77 Favored 'General case' 0 CA--C 1.508 -0.664 0 O-C-N 122.275 -0.544 . . . . 50.0 111.61 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.76 158.47 32.32 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 171.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -67.23 175.3 2.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.881 -0.599 . . . . 50.0 111.404 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.15 -178.86 19.32 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 110.73 -0.948 . . . . 50.0 110.73 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 mt -100.88 149.28 24.03 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.135 0.493 . . . . 50.0 112.192 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -130.07 151.68 78.76 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.378 0.671 . . . . 50.0 109.676 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.31 146.47 63.12 Favored 'Trans proline' 0 C--N 1.352 0.752 0 N-CA-C 115.11 1.158 . . . . 50.0 115.11 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -90.77 155.87 45.18 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 114.655 -1.157 . . . . 50.0 110.71 -176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -89.87 -17.94 1.58 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 N-CA-C 117.743 2.17 . . . . 50.0 117.743 -173.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -137.0 -50.42 0.65 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 117.3 2.333 . . . . 50.0 117.3 -168.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -74.41 164.08 27.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.531 0.567 . . . . 50.0 112.531 -171.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -65.76 -44.34 86.16 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 115.357 1.614 . . . . 50.0 115.357 -176.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 m -143.43 35.29 1.32 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.046 1.499 . . . . 50.0 115.046 -174.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.7 p -98.05 171.31 8.33 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.689 -1.597 . . . . 50.0 106.689 175.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -147.48 172.66 13.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.471 0.653 . . . . 50.0 109.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -105.95 148.42 27.67 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 103.761 -2.681 . . . . 50.0 103.761 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -134.16 139.99 46.25 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.874 -1.899 . . . . 50.0 105.874 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -116.15 129.57 56.38 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.48 -0.933 . . . . 25.0 108.48 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.97 114.54 9.82 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.813 -1.18 . . . . 25.0 107.813 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.25 38.52 27.86 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.212 0.605 . . . . 25.0 112.168 -178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.63 1.91 73.41 Favored Glycine 0 N--CA 1.465 0.593 0 N-CA-C 115.316 0.886 . . . . 25.0 115.316 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -98.52 148.02 24.18 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 107.56 -1.274 . . . . 50.0 107.56 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.1 tp -100.98 132.81 46.22 Favored 'General case' 0 C--O 1.218 -0.576 0 O-C-N 123.799 0.687 . . . . 50.0 111.539 -176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -119.67 142.73 48.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.688 -1.597 . . . . 50.0 106.688 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -122.45 115.76 22.79 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.056 -2.201 . . . . 50.0 105.056 174.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -139.79 171.04 14.79 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.646 -0.502 . . . . 50.0 109.646 -171.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -110.66 155.72 22.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.41 0.893 . . . . 50.0 113.41 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.19 89.94 22.38 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 105.292 -2.114 . . . . 50.0 105.292 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.49 -52.33 0.05 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 0 N-CA-C 118.846 2.595 . . . . 50.0 118.846 -166.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 m -104.24 106.68 17.26 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.32 1.6 . . . . 25.0 115.32 -170.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.88 -4.89 14.34 Favored Glycine 0 N--CA 1.467 0.703 0 N-CA-C 114.318 0.487 . . . . 25.0 114.318 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.26 136.47 34.52 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.226 0.61 . . . . 25.0 110.868 -175.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.7 m -131.5 149.6 33.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 108.528 -0.916 . . . . 50.0 108.528 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -80.49 138.64 36.58 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.652 -0.499 . . . . 50.0 109.652 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -119.37 113.44 20.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.976 0.893 . . . . 50.0 110.086 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.8 -19.91 65.38 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.154 0.798 . . . . 25.0 113.154 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.2 p -75.18 -36.02 61.5 Favored 'General case' 0 C--O 1.219 -0.533 0 O-C-N 122.005 -0.435 . . . . 50.0 111.722 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.1 p -102.07 -7.78 21.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.635 0.976 . . . . 25.0 113.635 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 mptt 57.82 36.9 26.84 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 106.995 -1.483 . . . . 50.0 106.995 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.3 p -140.9 166.49 24.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 25.0 108.872 -174.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.1 t -113.98 137.27 51.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.333 -2.099 . . . . 50.0 105.333 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.1 t -141.0 160.23 40.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.136 0.493 . . . . 25.0 109.737 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -74.1 139.29 44.48 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.949 -1.13 . . . . 50.0 107.949 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -75.07 124.59 27.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.953 0.406 . . . . 50.0 110.417 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -103.46 -1.02 47.03 Favored Glycine 0 C--O 1.224 -0.512 0 CA-C-N 116.147 -0.479 . . . . 25.0 114.248 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.0 tt -101.67 118.61 37.3 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.026 -0.691 . . . . 50.0 111.18 -177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 73.8 t -109.83 114.2 56.72 Favored Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 108.084 -1.08 . . . . 50.0 108.084 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -91.56 21.58 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.694 1.596 . . . . 50.0 112.794 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 . . . . . 0 CA--C 1.509 -0.619 0 CA-C-O 117.265 -1.35 . . . . 50.0 109.61 -177.661 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.704 0 CA-C-O 119.598 -0.557 . . . . 25.0 111.877 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.6 p -153.79 162.89 25.59 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.59 146.43 67.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 116.698 -1.735 . . . . 25.0 113.898 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -29.49 68.68 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 116.372 1.989 . . . . 25.0 116.372 -174.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.85 -33.6 72.01 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.781 0.66 . . . . 50.0 112.781 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -109.61 8.04 24.79 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.165 0.507 . . . . 25.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -78.14 126.85 31.41 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 121.248 -0.908 . . . . 50.0 108.731 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 21.12 80.05 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.455 -0.878 . . . . 25.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -118.48 146.79 44.23 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.137 -1.06 . . . . 50.0 108.137 178.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 150.94 46.52 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 106.988 -1.486 . . . . 25.0 106.988 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.95 148.45 46.0 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 106.973 -1.491 . . . . 50.0 106.973 174.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -168.25 25.54 Favored Glycine 0 C--N 1.316 -0.578 0 N-CA-C 109.28 -1.528 . . . . 50.0 109.28 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.0 mt -105.76 147.17 28.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.218 0.509 . . . . 50.0 110.86 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -129.49 150.8 76.64 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.164 -0.471 . . . . 50.0 109.773 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.9 141.61 37.32 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 117.758 -1.028 . . . . 50.0 114.206 -178.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -92.04 133.32 30.58 Favored Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 104.34 -2.467 . . . . 50.0 104.34 172.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -73.5 -19.0 22.3 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 115.247 1.21 . . . . 50.0 115.247 -175.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -97.94 -35.86 10.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.306 0.574 . . . . 50.0 111.685 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.09 158.89 17.8 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 113.38 0.882 . . . . 50.0 113.38 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -100.68 -42.38 6.54 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 112.489 0.552 . . . . 50.0 112.489 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.0 m -113.27 -25.6 8.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.747 0.647 . . . . 50.0 112.747 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 10.4 m -78.17 151.08 33.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.549 -0.908 . . . . 50.0 108.549 177.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -141.25 172.84 12.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.424 0.631 . . . . 50.0 111.756 -171.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -100.38 151.79 21.11 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.18 -2.526 . . . . 50.0 104.18 170.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.0 t -142.7 145.7 33.64 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 108.781 -0.822 . . . . 50.0 108.781 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.3 m -126.43 136.22 52.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.01 -1.478 . . . . 25.0 107.01 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.72 117.96 7.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.693 -1.225 . . . . 25.0 107.693 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.07 34.59 20.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.064 0.946 . . . . 25.0 110.384 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.34 2.95 69.13 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 115.975 -0.557 . . . . 25.0 113.507 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -90.38 144.89 25.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.026 -1.472 . . . . 50.0 107.026 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.38 133.77 34.78 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 123.245 0.34 . . . . 50.0 110.567 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.81 139.89 52.77 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 106.634 -1.617 . . . . 50.0 106.634 169.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -123.6 115.82 22.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.601 -2.74 . . . . 50.0 103.601 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.93 165.72 26.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 50.0 110.817 -169.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.7 p -109.34 154.76 22.07 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.184 -0.462 . . . . 50.0 111.466 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -116.13 98.3 51.04 Favored Pre-proline 0 C--N 1.317 -0.83 0 N-CA-C 103.981 -2.6 . . . . 50.0 103.981 171.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.39 -92.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.311 0 N-CA-C 117.666 2.141 . . . . 50.0 117.666 -164.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.525 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.6 OUTLIER -72.45 114.91 11.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.09 -1.631 . . . . 25.0 114.448 -167.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.31 8.75 85.73 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 115.558 0.983 . . . . 25.0 115.558 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.1 mt -122.12 154.71 37.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.146 0.498 . . . . 25.0 112.101 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.4 m -139.0 160.6 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 107.483 -1.303 . . . . 50.0 107.483 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -87.79 142.83 27.51 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.693 -0.803 . . . . 50.0 108.919 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.3 t -126.02 107.31 10.31 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.539 0.685 . . . . 50.0 110.472 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -65.33 -25.09 67.46 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.516 -0.766 . . . . 25.0 112.618 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -65.07 -29.99 70.91 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.498 0.555 . . . . 50.0 112.498 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.92 -2.09 18.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.565 0.166 . . . . 25.0 111.445 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 54.14 37.55 27.32 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.47 -0.567 . . . . 50.0 109.47 -172.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.65 167.9 21.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 25.0 109.971 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.0 t -97.4 140.3 32.07 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.418 -1.697 . . . . 50.0 106.418 175.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 80.6 p -137.89 168.44 19.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.508 0.67 . . . . 25.0 111.781 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -67.43 163.85 20.0 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.604 -1.628 . . . . 50.0 106.604 168.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -55.53 129.47 39.04 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.852 -0.795 . . . . 50.0 108.852 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.09 48.49 2.76 Favored Glycine 0 N--CA 1.464 0.509 0 N-CA-C 119.175 2.43 . . . . 25.0 119.175 -167.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 tt -74.11 124.57 26.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 107.425 -1.324 . . . . 50.0 107.425 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.4 t -78.08 117.05 63.63 Favored Pre-proline 0 CA--C 1.548 0.874 0 N-CA-C 109.18 -0.674 . . . . 50.0 109.18 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -91.74 9.64 2.79 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 N-CA-C 115.623 1.355 . . . . 50.0 115.623 -174.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.5 ptt85 . . . . . 0 C--O 1.249 1.033 0 N-CA-C 108.533 -0.914 . . . . 50.0 108.533 -174.643 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 CA-C-O 118.595 -1.114 . . . . 25.0 111.269 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 t -67.68 142.5 96.01 Favored Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 107.214 -1.402 . . . . 25.0 107.214 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.97 154.95 53.2 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 116.448 -1.901 . . . . 25.0 112.844 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.4 p -70.42 -12.17 61.4 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 121.355 0.597 . . . . 25.0 110.795 177.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -55.69 -37.07 67.86 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.747 0.819 . . . . 50.0 112.748 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.0 t -107.18 -9.76 16.04 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.464 0.65 . . . . 25.0 112.063 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -73.33 128.16 34.7 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.203 -0.936 . . . . 50.0 109.066 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.52 6.2 89.36 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.827 -0.701 . . . . 25.0 112.602 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -94.92 145.71 24.73 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.115 -0.698 . . . . 50.0 109.115 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.91 148.19 44.58 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.937 -2.246 . . . . 25.0 104.937 172.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -66.59 146.19 54.77 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.523 -1.288 . . . . 50.0 107.523 176.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.59 -177.96 22.8 Favored Glycine 0 C--O 1.238 0.349 0 N-CA-C 110.383 -1.087 . . . . 50.0 110.383 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.9 mt -100.71 139.92 35.71 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.184 0.809 . . . . 50.0 113.184 -177.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -124.97 146.31 53.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 108.103 -1.073 . . . . 50.0 108.103 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.81 150.57 62.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 N-CA-C 114.336 0.86 . . . . 50.0 114.336 -175.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -98.98 132.81 22.91 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 116.242 -0.436 . . . . 50.0 110.208 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.45 -19.3 10.33 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.373 1.259 . . . . 50.0 115.373 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -88.53 -39.17 14.36 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.266 0.469 . . . . 50.0 112.266 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -118.82 148.85 42.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.555 0.693 . . . . 50.0 112.611 -173.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -58.34 6.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.144 -0.934 . . . . 50.0 113.014 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.1 m -98.06 12.05 35.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 115.718 1.747 . . . . 50.0 115.718 -172.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.9 p -103.98 164.95 11.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.329 -0.548 . . . . 50.0 110.152 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -146.07 173.66 11.99 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.793 0.806 . . . . 50.0 109.853 -177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -107.9 140.44 41.02 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 103.333 -2.839 . . . . 50.0 103.333 170.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.9 t -126.24 122.39 35.4 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.817 -1.179 . . . . 50.0 107.817 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.1 m -97.87 127.7 43.99 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.345 -2.094 . . . . 25.0 105.345 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.38 115.04 7.7 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.498 -1.297 . . . . 25.0 107.498 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.96 34.52 22.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.784 0.834 . . . . 25.0 111.479 -176.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.45 13.23 80.11 Favored Glycine 0 C--O 1.239 0.437 0 C-N-CA 120.986 -0.626 . . . . 25.0 114.069 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 mmt-85 -106.71 146.38 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.975 -1.861 . . . . 50.0 105.975 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.45 109.99 22.07 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.226 0.329 . . . . 50.0 111.08 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -101.53 135.44 43.04 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.964 -1.495 . . . . 50.0 106.964 173.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -113.87 109.46 18.56 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 105.437 -2.061 . . . . 50.0 105.437 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -141.84 -179.44 6.2 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.884 -0.784 . . . . 50.0 108.884 -169.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.4 p -136.94 164.67 27.78 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.949 0.722 . . . . 50.0 112.949 -177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.32 80.94 37.44 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.523 -1.288 . . . . 50.0 107.523 175.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -82.53 -74.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.03 0 N-CA-C 117.123 1.932 . . . . 50.0 117.123 -173.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.45 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.2 OUTLIER -77.33 115.29 16.99 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 114.004 1.112 . . . . 25.0 114.004 -172.286 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.56 11.62 80.29 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.871 -0.68 . . . . 25.0 114.576 173.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.3 mt -133.36 154.73 50.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.202 0.501 . . . . 25.0 110.469 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.7 m -141.46 157.69 21.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 107.96 -1.126 . . . . 50.0 107.96 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -93.79 126.4 38.95 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.728 -0.607 . . . . 50.0 109.799 177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.1 t -106.75 96.3 6.35 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.584 -0.895 . . . . 50.0 108.584 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -60.94 -27.82 68.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 25.0 111.533 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -31.17 72.27 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.03 0.752 . . . . 50.0 113.03 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 2.3 p -103.21 -8.83 20.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.715 0.293 . . . . 25.0 110.879 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 tptt 64.8 23.07 12.64 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.911 0.885 . . . . 50.0 111.481 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.13 169.17 16.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.113 -0.949 . . . . 25.0 111.409 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.2 t -93.35 139.39 30.72 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.911 -1.885 . . . . 50.0 105.911 173.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.3 p -128.4 161.46 29.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.071 0.463 . . . . 25.0 110.537 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.4 t90 -70.51 138.68 51.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 50.0 111.919 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -78.36 132.07 37.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.78 -1.193 . . . . 50.0 107.78 175.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.33 -2.01 50.35 Favored Glycine 0 C--O 1.228 -0.223 0 N-CA-C 111.213 -0.755 . . . . 25.0 111.213 -177.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.58 127.17 30.17 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.677 -1.231 . . . . 50.0 107.677 174.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.4 t -82.43 121.72 78.49 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 108.223 -1.029 . . . . 50.0 108.223 -177.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -86.65 9.27 4.06 Favored 'Trans proline' 0 C--N 1.35 0.611 0 N-CA-C 115.066 1.141 . . . . 50.0 115.066 -175.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.244 0.811 0 N-CA-C 109.17 -0.678 . . . . 50.0 109.17 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.594 0 CA-C-O 118.331 -1.261 . . . . 25.0 111.528 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 t -151.98 144.05 16.43 Favored Pre-proline 0 C--O 1.24 0.602 0 CA-C-N 118.799 1.3 . . . . 25.0 107.611 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -71.19 139.37 35.24 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 116.887 -1.609 . . . . 25.0 112.991 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.3 p -82.59 7.07 15.64 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.648 0.737 . . . . 25.0 111.037 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -47.76 -52.92 16.88 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.868 1.062 . . . . 50.0 113.868 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.21 -1.93 15.94 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.834 0.679 . . . . 25.0 112.834 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -66.75 138.59 57.49 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 120.783 -1.198 . . . . 50.0 109.067 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.03 4.01 90.39 Favored Glycine 0 C--O 1.247 0.919 0 C-N-CA 121.093 -0.575 . . . . 25.0 113.181 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -113.92 154.94 26.69 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 106.075 -1.824 . . . . 50.0 106.075 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.75 151.7 46.94 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.205 -0.665 . . . . 25.0 109.205 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.49 131.68 48.91 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.836 -1.542 . . . . 50.0 106.836 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 158.92 -177.42 35.51 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 110.724 -0.95 . . . . 50.0 110.724 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.6 mt -97.32 147.82 23.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.34 . . . . 50.0 110.571 -178.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -134.21 146.65 60.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 109.082 -0.71 . . . . 50.0 109.082 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -71.35 149.44 56.84 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 117.908 -0.928 . . . . 50.0 114.32 -172.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -95.74 129.63 33.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 106.388 -1.708 . . . . 50.0 106.388 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -80.84 -16.71 10.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 N-CA-C 114.884 1.071 . . . . 50.0 114.884 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -92.53 -39.08 11.57 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.727 0.411 . . . . 50.0 111.219 -176.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -110.54 171.7 7.3 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.717 0.77 . . . . 50.0 109.957 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -109.63 -36.48 5.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.655 -0.702 . . . . 50.0 112.81 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 t -86.9 -26.09 24.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.169 -0.923 . . . . 50.0 112.743 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 55.6 p -89.39 158.77 17.63 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 121.367 -0.833 . . . . 50.0 110.698 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -139.26 169.54 17.58 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.538 0.685 . . . . 50.0 109.3 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -103.56 150.03 24.32 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 102.914 -2.995 . . . . 50.0 102.914 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.8 t -140.13 141.2 36.1 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.916 -1.513 . . . . 50.0 106.916 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t -117.05 122.51 44.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.16 120.26 12.87 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.79 34.91 24.36 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.8 0.809 . . . . 25.0 112.01 -177.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.91 3.56 84.49 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.956 -0.566 . . . . 25.0 114.478 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -102.05 138.8 38.53 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.046 -1.094 . . . . 50.0 108.046 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.58 119.22 26.6 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.983 -0.747 . . . . 50.0 108.983 178.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -109.58 143.66 38.97 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.32 -1.733 . . . . 50.0 106.32 172.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -128.66 116.79 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.203 -2.147 . . . . 50.0 105.203 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -145.3 169.07 18.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.252 0.478 . . . . 50.0 110.464 -172.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.6 p -107.6 157.81 17.75 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.998 0.519 . . . . 50.0 111.64 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.17 88.3 31.9 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 107.391 -1.337 . . . . 50.0 107.391 173.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.77 -78.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.29 0 N-CA-C 119.486 2.841 . . . . 50.0 119.486 -170.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.08 96.39 1.06 Allowed 'General case' 0 C--O 1.242 0.66 0 N-CA-C 116.534 2.05 . . . . 25.0 116.534 -166.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.81 13.21 83.29 Favored Glycine 0 C--O 1.22 -0.749 0 CA-C-N 114.978 -1.01 . . . . 25.0 112.568 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.6 mt -107.03 137.75 44.5 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.638 0.732 . . . . 25.0 112.697 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.3 m -133.09 147.87 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.417 -0.81 . . . . 50.0 110.241 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -90.88 134.7 34.26 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.132 0.491 . . . . 50.0 110.732 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.7 t -114.02 102.68 10.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.649 1.214 . . . . 50.0 109.705 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.38 -24.18 64.75 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.688 0.996 . . . . 25.0 113.688 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 p -64.93 -35.63 81.77 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 111.689 0.255 . . . . 50.0 111.689 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.3 p -110.91 -2.54 15.99 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 113.706 1.002 . . . . 25.0 113.706 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 61.85 33.38 17.68 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.716 0.807 . . . . 50.0 111.152 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -113.52 166.72 11.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.091 0.472 . . . . 25.0 109.758 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -114.68 129.44 56.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 102.97 -2.974 . . . . 50.0 102.97 165.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.9 p -124.51 157.68 34.73 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.727 -0.471 . . . . 25.0 109.727 -174.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -79.97 145.01 32.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.596 -0.89 . . . . 50.0 108.596 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -80.37 82.1 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.501 0.667 . . . . 50.0 112.591 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -93.2 24.7 23.83 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.796 -0.638 . . . . 25.0 112.843 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.6 tt -66.72 132.77 48.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 117.207 0.503 . . . . 50.0 109.752 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -113.84 121.46 36.96 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 107.177 -1.416 . . . . 50.0 107.177 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -89.47 15.49 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 121.012 1.141 . . . . 50.0 113.662 -174.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 . . . . . 0 C--O 1.246 0.908 0 N-CA-C 108.682 -0.859 . . . . 50.0 108.682 -178.391 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 118.993 -0.893 . . . . 25.0 111.291 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.7 m -81.01 146.16 58.48 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 118.203 1.002 . . . . 25.0 110.323 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.26 142.47 41.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 116.788 -1.675 . . . . 25.0 111.85 176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.4 p -81.39 -10.79 59.46 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 120.873 0.368 . . . . 25.0 111.956 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -57.83 -31.08 66.29 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.082 1.142 . . . . 50.0 114.082 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 m -111.69 2.0 17.0 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.654 0.613 . . . . 25.0 112.654 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -78.95 134.14 36.85 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.878 -1.527 . . . . 50.0 106.878 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.62 4.29 89.14 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.767 -0.73 . . . . 25.0 112.008 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -113.32 148.96 34.65 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 108.476 -0.935 . . . . 50.0 108.476 176.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 150.79 43.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.048 -1.834 . . . . 25.0 106.048 173.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.06 150.02 48.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.796 -1.187 . . . . 50.0 107.796 176.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -171.44 24.3 Favored Glycine 0 C--O 1.237 0.294 0 N-CA-C 110.241 -1.143 . . . . 50.0 110.241 -176.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.7 mt -105.94 141.0 38.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.558 0.694 . . . . 50.0 112.464 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -124.4 150.3 63.93 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 107.908 -1.145 . . . . 50.0 107.908 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -67.75 147.4 75.35 Favored 'Trans proline' 0 C--N 1.35 0.625 0 N-CA-C 114.325 0.856 . . . . 50.0 114.325 -176.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -92.04 154.96 43.41 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 114.86 -1.064 . . . . 50.0 111.175 -177.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.0 -33.24 19.97 Favored 'Trans proline' 0 CA--C 1.545 1.049 0 N-CA-C 116.71 1.773 . . . . 50.0 116.71 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -162.3 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 113.698 0.999 . . . . 50.0 113.698 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 36.25 -105.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.718 1.377 . . . . 50.0 114.718 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 -61.86 0.12 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.088 0.471 . . . . 50.0 111.545 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.7 p -150.94 37.94 0.65 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.169 0.985 . . . . 50.0 110.243 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.0 p -98.8 168.91 9.83 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.478 -1.237 . . . . 50.0 109.662 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -145.68 172.73 12.85 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.848 -0.797 . . . . 50.0 108.848 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -102.76 137.17 41.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 102.86 -3.015 . . . . 50.0 102.86 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.1 t -126.72 135.47 51.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.468 -0.938 . . . . 50.0 108.468 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.8 m -113.69 127.75 56.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.545 -1.65 . . . . 25.0 106.545 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.48 122.12 12.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.52 31.59 17.39 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 124.07 0.948 . . . . 25.0 110.969 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.37 11.83 79.86 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.864 -0.607 . . . . 25.0 114.231 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -108.9 151.1 26.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.174 -1.047 . . . . 50.0 108.174 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 49.5 tp -92.29 129.51 38.21 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.317 0.385 . . . . 50.0 111.907 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -122.69 134.11 54.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.342 -2.096 . . . . 50.0 105.342 167.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -113.95 112.69 23.72 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 104.852 -2.277 . . . . 50.0 104.852 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -140.44 173.44 11.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.577 -0.527 . . . . 50.0 109.577 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.5 p -122.51 159.51 27.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.737 1.014 . . . . 50.0 113.737 -177.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.89 72.11 62.49 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 107.444 -1.317 . . . . 50.0 107.444 177.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -82.88 -60.67 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.753 0 N-CA-C 117.62 2.123 . . . . 50.0 117.62 -170.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 p -80.63 111.04 16.69 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.938 1.088 . . . . 25.0 113.938 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.33 14.91 76.98 Favored Glycine 0 C--O 1.221 -0.684 0 C-N-CA 120.706 -0.759 . . . . 25.0 113.795 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.7 mt -124.93 149.57 47.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.782 0.791 . . . . 25.0 112.225 -171.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 m -139.16 148.77 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 122.839 0.456 . . . . 50.0 109.87 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -93.41 131.41 38.62 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.979 -0.451 . . . . 50.0 110.003 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.6 t -115.97 109.18 17.21 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.628 -0.879 . . . . 50.0 108.628 176.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -65.69 -28.27 68.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.367 0.506 . . . . 25.0 112.367 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.1 p -70.62 -34.57 72.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.687 0.28 . . . . 50.0 110.494 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.7 t -79.38 -21.85 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.655 -0.498 . . . . 25.0 109.655 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 59.31 29.73 19.33 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.412 -0.959 . . . . 50.0 108.412 -171.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.9 p -144.55 168.46 20.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.114 -0.948 . . . . 25.0 110.126 -174.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.1 t -105.23 134.77 47.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.714 -1.958 . . . . 50.0 105.714 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.8 p -121.03 159.9 24.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.935 0.398 . . . . 25.0 110.056 -176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -72.9 136.17 45.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.799 -1.556 . . . . 50.0 106.799 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -73.07 149.4 43.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.668 -0.493 . . . . 50.0 109.668 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.66 14.46 61.34 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 121.051 -0.595 . . . . 25.0 112.357 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.5 tp -62.36 122.92 16.9 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.297 -0.631 . . . . 50.0 109.297 176.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.2 t -84.28 122.79 75.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 107.88 -1.156 . . . . 50.0 107.88 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -74.75 -13.86 21.91 Favored 'Trans proline' 0 C--N 1.351 0.687 0 N-CA-C 114.828 1.049 . . . . 50.0 114.828 -177.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 124.457 1.103 . . . . 50.0 110.086 -177.729 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 CA-C-O 118.547 -1.141 . . . . 25.0 111.42 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.6 t -150.4 141.88 15.14 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 107.165 -1.42 . . . . 25.0 107.165 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -74.36 165.03 32.73 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 116.953 -1.564 . . . . 25.0 112.056 178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p -80.87 1.92 28.74 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.329 0.585 . . . . 25.0 111.298 176.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -57.16 -44.6 83.62 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.855 1.058 . . . . 50.0 113.855 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 m -100.91 1.44 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.905 0.383 . . . . 25.0 111.931 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.47 134.64 39.47 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 107.604 -1.258 . . . . 50.0 107.604 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.17 13.72 81.54 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.988 -0.625 . . . . 25.0 112.482 -177.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -118.62 155.59 30.7 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.915 -1.143 . . . . 50.0 107.915 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.85 155.87 28.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 105.586 -2.005 . . . . 25.0 105.586 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -70.23 148.74 48.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.69 -1.226 . . . . 50.0 107.69 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.81 -173.39 24.05 Favored Glycine 0 C--O 1.238 0.394 0 N-CA-C 110.037 -1.225 . . . . 50.0 110.037 -176.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.7 mt -96.49 153.7 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.611 0.706 . . . . 50.0 110.551 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -135.46 149.02 68.33 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 107.925 -1.139 . . . . 50.0 107.925 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -67.11 144.31 68.83 Favored 'Trans proline' 0 C--N 1.355 0.904 0 N-CA-C 115.632 1.359 . . . . 50.0 115.632 -173.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 p-10 -83.73 154.22 64.83 Favored Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 114.358 -1.292 . . . . 50.0 110.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.83 -24.21 2.3 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 N-CA-C 118.442 2.439 . . . . 50.0 118.442 -172.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -140.48 -36.45 0.48 Allowed 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.641 2.089 . . . . 50.0 116.641 -170.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -76.91 176.71 8.33 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.711 -0.677 . . . . 50.0 111.341 -172.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -69.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.744 1.016 . . . . 50.0 113.744 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -113.61 16.59 18.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.054 1.502 . . . . 50.0 115.054 -172.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.4 p -79.93 172.01 14.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.363 -0.976 . . . . 50.0 108.363 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -156.61 170.73 21.72 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.37 0.605 . . . . 50.0 110.332 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -103.66 150.03 24.39 Favored 'General case' 0 CA--C 1.502 -0.866 0 N-CA-C 103.104 -2.924 . . . . 50.0 103.104 170.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.6 t -133.99 133.07 40.87 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.012 -1.477 . . . . 50.0 107.012 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.2 m -107.85 127.35 53.64 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.712 -1.958 . . . . 25.0 105.712 174.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.98 121.55 14.18 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.104 -1.443 . . . . 25.0 107.104 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.09 31.88 19.02 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.875 0.87 . . . . 25.0 110.034 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.54 9.55 69.26 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.885 -0.598 . . . . 25.0 114.533 -178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -103.56 150.01 24.35 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.064 -1.087 . . . . 50.0 108.064 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.1 tp -91.3 130.01 37.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.39 0.515 . . . . 50.0 112.39 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -122.86 134.74 54.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.74 -1.948 . . . . 50.0 105.74 167.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -113.94 123.31 49.44 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 104.959 -2.237 . . . . 50.0 104.959 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -138.57 161.31 37.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.959 0.409 . . . . 50.0 111.19 -174.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.0 p -110.43 141.22 43.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.349 -0.982 . . . . 50.0 108.349 177.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -98.99 127.81 33.99 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 102.909 -2.997 . . . . 50.0 102.909 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.74 -106.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 N-CA-C 116.052 1.52 . . . . 50.0 116.052 -166.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.2 t -105.58 152.82 22.6 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.448 -0.783 . . . . 25.0 112.372 -174.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.62 2.4 64.02 Favored Glycine 0 C--O 1.235 0.206 0 N-CA-C 114.767 0.667 . . . . 25.0 114.767 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.2 mt -131.58 155.28 47.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 25.0 111.279 -174.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.85 157.28 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 107.643 -1.244 . . . . 50.0 107.643 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -82.74 130.29 35.1 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 50.0 109.208 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.2 t -115.94 109.79 18.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.512 0.672 . . . . 50.0 109.631 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.49 -25.66 68.09 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.324 0.861 . . . . 25.0 113.324 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.4 p -66.5 -38.11 86.53 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.922 0.712 . . . . 50.0 112.922 -175.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.1 p -104.02 -8.23 19.72 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.391 -0.596 . . . . 25.0 109.391 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.4 tptt 63.29 33.01 14.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.108 -0.951 . . . . 50.0 112.044 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 163.84 20.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.424 -0.807 . . . . 25.0 110.271 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -86.86 125.13 33.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 102.898 -3.001 . . . . 50.0 102.898 165.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.2 p -121.24 161.75 21.41 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.59 136.88 56.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.094 -0.957 . . . . 50.0 110.849 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -83.58 30.09 0.5 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.338 0.866 . . . . 50.0 113.338 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 55.47 45.26 84.55 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 116.002 1.161 . . . . 25.0 116.002 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 tt -63.65 126.89 29.04 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.002 -0.705 . . . . 50.0 109.571 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.61 118.72 71.71 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 107.52 -1.289 . . . . 50.0 107.52 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.93 -5.49 16.41 Favored 'Trans proline' 0 C--N 1.353 0.789 0 N-CA-C 114.765 1.025 . . . . 50.0 114.765 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 . . . . . 0 C--O 1.248 0.998 0 CA-C-O 116.716 -1.611 . . . . 50.0 110.41 -178.801 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 118.858 -0.968 . . . . 25.0 111.399 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t -150.64 147.14 20.61 Favored Pre-proline 0 N--CA 1.468 0.445 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.1 146.55 58.45 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 115.997 -2.202 . . . . 25.0 112.283 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.7 p -106.05 6.5 31.2 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.927 -0.579 . . . . 25.0 110.789 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.26 -35.84 60.48 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.756 1.762 . . . . 50.0 115.756 -174.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.7 t -105.11 -6.61 19.76 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.121 0.486 . . . . 25.0 111.244 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -71.83 127.45 32.59 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.264 -0.898 . . . . 50.0 109.138 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.55 5.39 88.46 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.977 -0.63 . . . . 25.0 113.28 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -107.68 145.51 33.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 117.475 0.637 . . . . 50.0 110.11 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.15 153.71 41.49 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.145 -1.057 . . . . 25.0 108.145 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -67.21 160.45 26.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.079 -0.51 . . . . 50.0 109.721 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.54 16.5 Favored Glycine 0 C--O 1.235 0.158 0 N-CA-C 110.601 -0.999 . . . . 50.0 110.601 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 mt -96.38 147.27 23.99 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.368 0.877 . . . . 50.0 113.368 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -129.77 151.72 78.61 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 106.201 -1.778 . . . . 50.0 106.201 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.59 144.44 60.52 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 117.799 -1.001 . . . . 50.0 113.815 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -80.99 158.08 70.58 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.875 0.87 . . . . 50.0 112.598 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -86.52 -23.67 1.72 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 N-CA-C 119.093 2.69 . . . . 50.0 119.093 -172.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -136.29 -44.72 0.62 Allowed 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 115.588 1.699 . . . . 50.0 115.588 -170.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -71.24 166.37 21.69 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.69 -1.141 . . . . 50.0 111.326 -173.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.9 tpt85 -77.2 -39.51 48.45 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.696 0.998 . . . . 50.0 113.696 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -128.39 3.73 5.68 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 118.95 2.944 . . . . 50.0 118.95 -167.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.8 p -85.89 178.07 7.41 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.301 -1.5 . . . . 50.0 109.265 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -143.14 170.98 14.71 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.456 0.646 . . . . 50.0 109.792 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -101.42 144.52 30.11 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 101.727 -3.434 . . . . 50.0 101.727 167.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -135.56 136.67 41.31 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 107.659 -1.237 . . . . 50.0 107.659 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.97 129.9 56.03 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.78 117.62 8.75 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.62 33.96 22.25 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.74 0.816 . . . . 25.0 110.815 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.75 5.49 74.52 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.299 -0.477 . . . . 25.0 114.179 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -100.87 144.59 29.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.243 -1.021 . . . . 50.0 108.243 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -91.31 128.67 37.23 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.289 -0.414 . . . . 50.0 111.61 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.27 133.74 55.15 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.186 -1.783 . . . . 50.0 106.186 169.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -116.21 107.81 15.34 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 104.88 -2.267 . . . . 50.0 104.88 175.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -146.5 172.84 12.95 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 120.469 0.176 . . . . 50.0 110.971 -169.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.5 p -114.17 164.13 14.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.224 -2.139 . . . . 50.0 105.224 171.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.55 127.64 55.82 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 106.782 -1.562 . . . . 50.0 106.782 178.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.33 -52.05 0.93 Allowed 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 116.489 -1.874 . . . . 50.0 116.335 -172.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.78 131.23 53.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.984 0.735 . . . . 25.0 112.984 -178.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.34 22.75 78.56 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.213 -0.994 . . . . 25.0 115.191 168.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.44 118.98 3.67 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -149.36 157.27 6.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 102.755 -3.054 . . . . 50.0 102.755 160.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -119.92 132.3 55.49 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.983 -1.117 . . . . 50.0 107.983 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.8 t -116.34 111.89 20.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.925 -0.768 . . . . 50.0 108.925 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -62.75 -30.42 71.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.596 -0.729 . . . . 25.0 111.991 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.3 p -67.78 -33.09 74.14 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 112.655 0.613 . . . . 50.0 112.655 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.1 -5.61 43.85 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.694 -0.484 . . . . 25.0 109.694 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.95 29.09 17.11 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.582 0.753 . . . . 50.0 109.671 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -141.88 166.57 24.35 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 113.663 0.986 . . . . 25.0 113.663 -167.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.8 t -79.91 138.48 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.685 -1.598 . . . . 50.0 106.685 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.3 p -124.33 167.98 13.61 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.939 -1.504 . . . . 25.0 106.939 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -95.67 145.05 25.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.07 0.462 . . . . 50.0 109.97 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -80.44 96.69 6.81 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.896 0.702 . . . . 50.0 112.896 -174.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.31 3.89 90.38 Favored Glycine 0 C--O 1.228 -0.253 0 CA-C-N 115.81 -0.632 . . . . 25.0 114.532 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.26 156.72 46.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 122.35 -0.5 . . . . 50.0 110.342 -178.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 91.3 t -105.88 111.34 64.57 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 105.53 -2.026 . . . . 50.0 105.53 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -89.69 16.47 1.74 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 120.587 0.858 . . . . 50.0 113.389 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 . . . . . 0 C--O 1.241 0.607 0 CA-C-O 117.984 -1.007 . . . . 50.0 109.739 -177.512 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 118.064 -1.409 . . . . 25.0 111.19 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 t 52.18 70.73 1.74 Allowed Pre-proline 0 N--CA 1.479 1.013 0 N-CA-C 113.876 1.065 . . . . 25.0 113.876 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -70.52 151.97 65.06 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 116.597 -1.802 . . . . 25.0 112.943 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.2 p -77.58 2.94 14.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.283 0.564 . . . . 25.0 111.904 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -56.94 -43.67 81.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.268 0.84 . . . . 50.0 113.268 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.8 t -108.67 -16.41 14.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.386 0.613 . . . . 25.0 111.316 -178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -67.45 127.72 33.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 O-C-N 120.909 -1.119 . . . . 50.0 110.984 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.76 20.25 74.13 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 120.963 -0.637 . . . . 25.0 112.849 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -118.07 161.89 19.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.085 -1.45 . . . . 50.0 107.085 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.49 39.73 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.134 -1.802 . . . . 25.0 106.134 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -66.87 146.08 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.227 -1.397 . . . . 50.0 107.227 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.05 -178.36 25.69 Favored Glycine 0 C--N 1.322 -0.239 0 N-CA-C 110.993 -0.843 . . . . 50.0 110.993 -176.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.46 144.78 26.25 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.213 0.53 . . . . 50.0 112.023 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -131.7 154.28 81.76 Favored Pre-proline 0 C--N 1.322 -0.62 0 N-CA-C 108.638 -0.875 . . . . 50.0 108.638 -177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.11 137.59 37.74 Favored 'Trans proline' 0 C--N 1.351 0.663 0 N-CA-C 115.802 1.424 . . . . 50.0 115.802 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -83.51 159.2 61.88 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 125.121 1.368 . . . . 50.0 111.476 -178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.58 -24.8 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 N-CA-C 118.408 2.426 . . . . 50.0 118.408 -172.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -147.42 -44.41 0.17 Allowed 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.779 2.14 . . . . 50.0 116.779 -171.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -68.72 162.49 26.04 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 113.488 0.921 . . . . 50.0 113.488 -168.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -82.61 -34.54 27.59 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.233 0.827 . . . . 50.0 113.233 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.1 t -107.91 -21.71 12.73 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.426 1.639 . . . . 50.0 115.426 -170.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -82.56 164.03 21.11 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.342 -0.848 . . . . 50.0 112.706 -174.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -142.38 174.27 10.77 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 106.871 -1.529 . . . . 50.0 106.871 175.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -104.64 146.45 28.91 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 102.75 -3.056 . . . . 50.0 102.75 168.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.3 t -132.46 134.46 45.1 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.23 -1.396 . . . . 50.0 107.23 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.1 t -110.96 119.93 40.71 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 102.071 -3.307 . . . . 25.0 102.071 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.77 121.67 11.31 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.295 -0.631 . . . . 25.0 109.295 -175.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.36 31.23 18.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.057 0.943 . . . . 25.0 110.99 -176.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.55 8.43 84.06 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.149 -0.548 . . . . 25.0 113.689 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.72 151.43 30.26 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.642 -0.503 . . . . 50.0 109.642 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.29 132.27 34.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.976 -0.556 . . . . 50.0 111.343 -177.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -128.67 139.1 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.264 -1.754 . . . . 50.0 106.264 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -121.23 111.38 17.31 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.296 -2.113 . . . . 50.0 105.296 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.62 176.4 8.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.792 -0.818 . . . . 50.0 108.792 -171.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.5 p -124.28 156.38 37.02 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 115.477 1.658 . . . . 50.0 115.477 -174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -112.27 98.0 41.5 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.191 -1.411 . . . . 50.0 107.191 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.44 -91.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.302 0 N-CA-C 117.146 1.941 . . . . 50.0 117.146 -172.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -77.34 115.79 17.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 115.197 1.555 . . . . 25.0 115.197 -171.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 2.68 55.53 Favored Glycine 0 C--O 1.227 -0.312 0 N-CA-C 115.332 0.893 . . . . 25.0 115.332 172.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -105.1 134.66 47.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.108 0.454 . . . . 25.0 110.064 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -126.5 146.1 32.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 107.926 -1.139 . . . . 50.0 107.926 177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -81.9 132.64 35.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.376 -0.601 . . . . 50.0 109.376 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -118.89 109.33 15.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.014 0.912 . . . . 50.0 108.634 176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.99 -26.7 68.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.46 -0.791 . . . . 25.0 112.88 -176.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p -67.8 -29.76 69.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.542 0.571 . . . . 50.0 112.542 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 32.0 p -103.68 -5.3 22.72 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 121.425 -0.11 . . . . 25.0 111.225 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 54.66 39.44 31.26 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.682 -0.858 . . . . 50.0 108.682 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.6 p -146.88 168.77 20.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.57 -0.741 . . . . 25.0 110.299 -172.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 137.98 38.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.227 -1.768 . . . . 50.0 106.227 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -124.46 149.96 46.24 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.742 0.306 . . . . 25.0 110.201 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -72.98 135.01 44.92 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.846 -1.168 . . . . 50.0 107.846 174.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -84.66 67.59 10.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.144 0.497 . . . . 50.0 110.458 177.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.1 56.05 0.72 Allowed Glycine 0 C--O 1.223 -0.538 0 N-CA-C 110.996 -0.842 . . . . 25.0 110.996 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.11 131.42 49.47 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.86 0.362 . . . . 50.0 111.396 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -121.23 126.5 26.54 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 106.331 -1.729 . . . . 50.0 106.331 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -88.46 11.86 2.96 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 N-CA-C 114.892 1.074 . . . . 50.0 114.892 -174.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.243 0.744 0 N-CA-C 108.229 -1.026 . . . . 50.0 108.229 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.141 0 CA-C-O 119.185 -0.786 . . . . 25.0 111.507 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.2 m -136.51 153.15 75.89 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.32 144.69 46.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 116.011 -2.192 . . . . 25.0 112.022 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.9 p -75.13 -12.58 60.34 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-O 121.324 0.583 . . . . 25.0 110.502 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -55.69 -29.4 59.34 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.997 1.11 . . . . 50.0 113.997 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.2 t -112.31 -10.56 13.79 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.204 0.526 . . . . 25.0 112.396 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -72.68 126.68 30.47 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.327 -0.858 . . . . 50.0 109.376 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.04 2.1 84.04 Favored Glycine 0 C--O 1.225 -0.451 0 C-N-CA 121.302 -0.475 . . . . 25.0 113.004 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -101.03 147.56 26.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 O-C-N 122.264 -0.551 . . . . 50.0 111.839 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.13 161.47 26.87 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.872 -1.159 . . . . 25.0 107.872 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -72.32 179.8 3.25 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.228 0.537 . . . . 50.0 110.803 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.28 -176.63 24.55 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 112.046 -0.422 . . . . 50.0 112.046 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.404 ' CD2' ' HG ' ' A' ' 25' ' ' SER . 71.7 mt -96.76 145.76 25.52 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.006 0.432 . . . . 50.0 111.834 -179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.67 147.2 57.56 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 108.997 -0.742 . . . . 50.0 108.997 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.76 155.62 65.44 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 114.661 0.985 . . . . 50.0 114.661 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -95.24 153.81 39.61 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.129 0.972 . . . . 50.0 110.903 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.05 -26.57 10.7 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 117.149 -1.434 . . . . 50.0 115.711 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -163.76 -78.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.232 0.469 . . . . 50.0 111.258 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 38.62 -129.22 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.142 0.977 . . . . 50.0 112.297 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -136.43 -55.93 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.486 0.714 . . . . 50.0 110.152 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 m -156.56 47.4 0.45 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.161 0.43 . . . . 50.0 112.161 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -133.13 169.7 16.48 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 115.904 -0.589 . . . . 50.0 111.469 -174.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -153.64 174.34 14.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.978 -1.489 . . . . 75.0 106.978 -175.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -105.42 160.83 14.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.078 -1.082 . . . . 50.0 108.078 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.404 ' HG ' ' CD2' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -141.57 141.51 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.521 -0.918 . . . . 50.0 108.521 176.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.6 127.24 55.08 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 128.33 14.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.062 -1.459 . . . . 25.0 107.062 178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.34 30.67 10.58 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.095 0.776 . . . . 25.0 113.095 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.91 9.14 79.31 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.427 -0.416 . . . . 25.0 113.922 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -110.4 147.4 34.09 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.479 -0.934 . . . . 50.0 108.479 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -89.82 130.27 36.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.308 -0.86 . . . . 50.0 110.381 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -120.75 149.54 42.38 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.029 -2.582 . . . . 50.0 104.029 168.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -118.64 137.8 53.03 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 103.051 -2.944 . . . . 50.0 103.051 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -133.61 168.45 18.66 Favored 'General case' 0 CA--C 1.503 -0.863 0 O-C-N 123.293 0.37 . . . . 50.0 110.968 -173.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.0 p -136.9 159.1 42.86 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 102.145 -3.279 . . . . 50.0 102.145 170.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.1 m -123.17 78.54 52.26 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 104.091 -2.559 . . . . 50.0 104.091 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 -47.46 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 116.871 -1.619 . . . . 50.0 115.825 -167.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -100.95 116.21 32.26 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.055 1.131 . . . . 25.0 114.055 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.54 -11.44 6.99 Favored Glycine 0 N--CA 1.463 0.452 0 N-CA-C 118.791 2.277 . . . . 25.0 118.791 170.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.7 mt -120.79 152.66 38.08 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.44 1.12 . . . . 25.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.8 m -136.63 144.33 32.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.634 -0.876 . . . . 50.0 108.634 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -74.68 127.15 32.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.0 0.429 . . . . 50.0 110.927 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -112.88 111.49 22.29 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 122.033 0.92 . . . . 50.0 108.801 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -63.78 -21.97 66.68 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.781 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.2 p -67.95 -34.92 77.51 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.491 0.552 . . . . 50.0 112.491 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 3.1 p -104.28 -9.78 18.32 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 121.109 -0.236 . . . . 25.0 111.441 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 63.11 33.98 14.07 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.899 0.88 . . . . 50.0 110.591 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -142.83 166.68 23.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.642 -0.708 . . . . 25.0 109.26 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 m -86.8 146.83 26.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 106.735 -1.579 . . . . 50.0 106.735 169.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.17 160.7 27.27 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -67.76 130.18 42.21 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.205 -1.035 . . . . 50.0 108.205 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -82.01 103.27 11.53 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.937 1.088 . . . . 50.0 113.937 -173.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.4 -1.07 86.74 Favored Glycine 0 N--CA 1.459 0.183 0 N-CA-C 115.272 0.869 . . . . 25.0 115.272 172.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.02 155.32 27.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.079 -0.66 . . . . 50.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.1 t -85.14 125.93 68.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 107.724 -1.214 . . . . 50.0 107.724 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -88.68 16.1 1.92 Allowed 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.296 1.331 . . . . 50.0 113.969 -177.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 . . . . . 0 C--O 1.248 1.013 0 N-CA-C 108.54 -0.911 . . . . 50.0 108.54 -177.581 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.517 0 CA-C-O 119.06 -0.855 . . . . 25.0 111.35 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -71.5 147.91 92.8 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 107.764 -1.198 . . . . 25.0 107.764 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.24 124.8 11.23 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 116.512 -1.859 . . . . 25.0 113.605 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.6 p -86.24 30.79 0.67 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.33 0.863 . . . . 25.0 113.33 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -62.01 -41.47 98.1 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.747 -0.596 . . . . 50.0 112.465 -177.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.4 -12.0 9.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.576 0.703 . . . . 25.0 111.027 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.65 128.66 37.25 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 121.445 -0.785 . . . . 50.0 110.236 -177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.97 16.41 80.7 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 121.058 -0.592 . . . . 25.0 112.851 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -114.15 148.42 37.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 117.007 0.403 . . . . 50.0 110.647 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.15 150.81 47.11 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.472 -0.936 . . . . 25.0 108.472 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -68.77 164.66 21.31 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.357 0.598 . . . . 50.0 110.677 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.92 -175.13 16.0 Favored Glycine 0 CA--C 1.516 0.113 0 N-CA-C 110.306 -1.118 . . . . 50.0 110.306 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.1 mt -93.59 152.06 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.699 1.0 . . . . 50.0 113.699 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -133.68 148.79 69.95 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 106.892 -1.522 . . . . 50.0 106.892 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.98 145.5 35.82 Favored 'Trans proline' 0 C--N 1.349 0.555 0 N-CA-C 114.281 0.839 . . . . 50.0 114.281 -174.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -102.56 120.34 53.3 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 110.123 -0.325 . . . . 50.0 110.123 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.04 -18.1 14.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 116.31 -1.993 . . . . 50.0 113.808 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -70.34 -52.21 24.37 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 111.977 0.362 . . . . 50.0 111.977 -175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.81 141.07 52.17 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.363 -1.347 . . . . 50.0 107.363 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.26 -18.75 44.89 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.338 1.066 . . . . 50.0 108.326 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -77.71 -0.87 28.51 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.292 -1.777 . . . . 50.0 113.323 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 60.7 p -137.65 170.09 16.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.578 0.704 . . . . 50.0 112.172 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -143.52 172.56 12.62 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 50.0 108.741 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -107.79 152.8 23.88 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 102.959 -2.978 . . . . 50.0 102.959 171.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.7 t -140.02 142.75 36.22 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.137 -1.06 . . . . 50.0 108.137 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.49 128.91 56.47 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.682 -2.34 . . . . 25.0 104.682 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.55 113.72 6.94 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 107.234 -1.395 . . . . 25.0 107.234 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.35 34.86 24.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.786 0.834 . . . . 25.0 110.189 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.65 -1.49 57.7 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.691 0.636 . . . . 25.0 114.691 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -88.82 150.14 23.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.341 -0.985 . . . . 50.0 108.341 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.85 124.63 37.98 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 123.597 0.56 . . . . 50.0 109.821 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -118.99 136.5 54.07 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.275 -1.38 . . . . 50.0 107.275 172.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -117.28 118.36 32.05 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.564 -2.013 . . . . 50.0 105.564 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -142.06 157.92 44.35 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.158 0.435 . . . . 50.0 110.838 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.8 p -94.1 162.44 13.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.554 . . . . 50.0 109.886 177.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 44.9 t -114.62 122.63 33.59 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 107.258 -1.386 . . . . 50.0 107.258 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.62 -41.49 0.25 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 115.977 -2.215 . . . . 50.0 117.584 -173.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.1 m -103.66 117.32 34.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 115.653 1.723 . . . . 25.0 115.653 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.17 21.39 79.25 Favored Glycine 0 C--O 1.21 -1.404 0 C-N-CA 120.499 -0.857 . . . . 25.0 113.322 171.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.55 104.73 0.05 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 119.851 3.278 . . . . 25.0 119.851 -162.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -149.06 162.69 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 104.507 -2.405 . . . . 50.0 104.507 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -112.22 131.06 55.7 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.774 -0.579 . . . . 50.0 110.802 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 t -107.07 113.72 27.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.474 -0.565 . . . . 50.0 109.474 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.71 -35.32 79.36 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.657 0.614 . . . . 25.0 112.657 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.0 p -69.1 -33.14 73.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 120.769 0.319 . . . . 50.0 111.067 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 46.1 t -81.86 -22.13 37.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.672 -0.492 . . . . 25.0 109.672 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.2 tptt 59.97 26.86 16.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.684 -1.228 . . . . 50.0 107.684 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.0 p -142.03 167.86 21.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.273 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.47 138.06 35.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.912 -1.514 . . . . 50.0 106.912 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.0 p -131.39 168.01 18.32 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.905 -0.776 . . . . 25.0 108.905 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.6 m0 -75.64 148.48 38.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.26 -0.645 . . . . 50.0 109.26 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.2 93.51 2.83 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.846 0.684 . . . . 50.0 112.846 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.59 11.75 82.62 Favored Glycine 0 C--O 1.224 -0.491 0 N-CA-C 115.633 1.013 . . . . 25.0 115.633 174.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.7 tp -132.18 136.82 47.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.429 0.615 . . . . 50.0 110.039 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 44.0 t -122.21 125.66 26.51 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 106.526 -1.657 . . . . 50.0 106.526 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -76.72 -23.08 11.37 Favored 'Trans proline' 0 C--N 1.351 0.698 0 N-CA-C 117.389 2.034 . . . . 50.0 117.389 -173.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 . . . . . 0 C--O 1.244 0.772 0 N-CA-C 106.417 -1.697 . . . . 50.0 106.417 -176.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.088 0 CA-C-O 118.728 -1.04 . . . . 25.0 111.382 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -137.24 152.83 74.23 Favored Pre-proline 0 N--CA 1.468 0.452 0 N-CA-C 107.774 -1.195 . . . . 25.0 107.774 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.21 136.23 28.76 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 117.13 -1.446 . . . . 25.0 112.689 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p -81.91 -2.02 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.593 0.711 . . . . 25.0 111.824 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -63.01 -41.16 99.49 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.788 0.662 . . . . 50.0 112.788 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.8 t -95.99 -17.26 21.13 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.602 0.715 . . . . 25.0 111.007 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -68.16 132.39 47.1 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.069 -1.019 . . . . 50.0 109.071 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.44 12.81 79.83 Favored Glycine 0 C--O 1.226 -0.389 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.303 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -122.27 163.23 20.02 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.235 -1.395 . . . . 50.0 107.235 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.4 32.88 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 106.313 -1.736 . . . . 25.0 106.313 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.44 148.12 49.99 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.127 -1.064 . . . . 50.0 108.127 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.12 -177.28 23.66 Favored Glycine 0 C--O 1.237 0.315 0 N-CA-C 111.23 -0.748 . . . . 50.0 111.23 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.6 mt -96.46 139.75 32.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.146 0.498 . . . . 50.0 110.777 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -125.11 152.85 71.27 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 107.997 -1.112 . . . . 50.0 107.997 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.42 147.42 71.3 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 118.004 -0.864 . . . . 50.0 113.791 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -86.49 159.46 52.86 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 115.145 -0.934 . . . . 50.0 111.585 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -83.86 -20.19 4.6 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 118.032 2.282 . . . . 50.0 118.032 -172.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -146.01 -47.06 0.2 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.171 2.285 . . . . 50.0 117.171 -169.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -72.24 169.99 15.03 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.243 -0.435 . . . . 50.0 111.056 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -81.97 -50.49 9.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.192 1.182 . . . . 50.0 114.192 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 m -112.57 18.59 18.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 116.13 1.9 . . . . 50.0 116.13 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 86.9 p -102.07 165.46 11.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.173 0.442 . . . . 50.0 110.407 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -142.16 174.5 10.55 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.725 -0.843 . . . . 50.0 108.725 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -105.42 136.21 45.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 103.266 -2.865 . . . . 50.0 103.266 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -121.45 120.24 34.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.799 -1.185 . . . . 50.0 107.799 177.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.9 t -103.74 121.39 42.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 105.146 -2.168 . . . . 25.0 105.146 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -148.33 118.59 7.31 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.886 -0.413 . . . . 25.0 109.886 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.38 35.92 24.19 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.714 0.806 . . . . 25.0 112.335 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.01 3.38 84.58 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.071 -0.585 . . . . 25.0 113.639 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -104.74 150.8 24.45 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.053 -1.091 . . . . 50.0 108.053 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.7 tp -107.81 132.81 53.01 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.006 -0.739 . . . . 50.0 109.006 177.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -123.18 134.99 54.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 104.934 -2.247 . . . . 50.0 104.934 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -113.88 108.12 16.63 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 104.932 -2.247 . . . . 50.0 104.932 174.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -135.68 177.06 8.12 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.467 -0.938 . . . . 50.0 108.467 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -126.08 168.6 13.76 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.236 0.458 . . . . 50.0 112.236 -176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 81.2 m -100.19 98.23 7.37 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 105.739 -1.948 . . . . 50.0 105.739 171.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -84.98 -96.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 0 N-CA-C 116.002 1.501 . . . . 50.0 116.002 -172.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -73.78 114.89 12.57 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.187 -0.945 . . . . 25.0 113.402 -172.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.18 11.54 75.32 Favored Glycine 0 C--O 1.229 -0.209 0 CA-C-N 115.681 -0.691 . . . . 25.0 114.048 174.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 39.5 mt -124.95 153.73 42.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.48 0.64 . . . . 25.0 112.057 -173.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.0 m -139.23 161.66 28.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.021 -1.103 . . . . 50.0 108.021 177.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -93.21 132.75 37.09 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.007 -1.108 . . . . 50.0 108.007 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -111.24 101.91 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.249 0.547 . . . . 50.0 109.628 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.47 -19.09 64.44 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.704 1.001 . . . . 25.0 113.704 -175.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.436 ' HG ' ' H ' ' A' ' 46' ' ' CYS . 9.8 p -71.65 -52.09 19.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.969 -0.457 . . . . 50.0 111.302 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.436 ' H ' ' HG ' ' A' ' 45' ' ' SER . 21.8 p -101.09 -1.99 32.65 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.034 0.753 . . . . 25.0 113.034 -176.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.0 mptt 64.94 35.13 8.5 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.443 1.097 . . . . 50.0 108.457 177.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.6 m -105.58 157.21 17.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.233 -0.894 . . . . 25.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.1 t -103.26 121.64 43.13 Favored 'General case' 0 C--N 1.321 -0.652 1 N-CA-C 99.807 -4.146 . . . . 50.0 99.807 162.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -141.12 167.82 21.27 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -169.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -63.38 148.74 47.62 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.24 0.543 . . . . 50.0 111.916 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -68.06 1.32 2.83 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 115.601 1.704 . . . . 50.0 115.601 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.64 37.12 46.63 Favored Glycine 0 C--O 1.224 -0.521 0 C-N-CA 120.596 -0.811 . . . . 25.0 113.544 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.3 127.7 33.09 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 122.449 -0.442 . . . . 50.0 111.3 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 88.2 t -119.58 117.91 32.49 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 104.957 -2.238 . . . . 50.0 104.957 175.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.23 -25.4 7.16 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 117.134 -1.444 . . . . 50.0 115.612 -173.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 . . . . . 0 C--O 1.244 0.811 0 N-CA-C 105.306 -2.109 . . . . 50.0 105.306 -177.43 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 CA-C-O 118.939 -0.923 . . . . 25.0 111.231 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.2 p -150.05 165.19 18.08 Favored Pre-proline 0 C--O 1.238 0.479 0 N-CA-C 106.798 -1.556 . . . . 25.0 106.798 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.41 155.47 46.72 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.225 -1.383 . . . . 25.0 111.063 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 61.72 -0.48 0.41 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.905 1.817 . . . . 25.0 115.905 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -60.33 -39.4 86.91 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.482 -0.761 . . . . 50.0 112.971 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.07 -0.57 15.61 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 112.515 0.561 . . . . 25.0 112.515 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.36 127.33 32.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 108.889 -0.782 . . . . 50.0 108.889 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.22 13.84 82.87 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 121.137 -0.554 . . . . 25.0 112.508 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -104.9 147.12 28.11 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.352 -0.981 . . . . 50.0 108.352 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.4 154.16 38.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 106.844 -1.539 . . . . 25.0 106.844 177.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.19 149.4 49.59 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.529 -0.915 . . . . 50.0 108.529 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.72 -175.1 20.46 Favored Glycine 0 C--O 1.234 0.105 0 N-CA-C 111.329 -0.708 . . . . 50.0 111.329 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.9 mt -97.93 147.49 24.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 50.0 112.286 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -128.49 147.64 64.83 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 107.729 -1.211 . . . . 50.0 107.729 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -73.57 150.77 46.21 Favored 'Trans proline' 0 C--N 1.346 0.421 0 N-CA-C 114.453 0.905 . . . . 50.0 114.453 -175.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -94.35 121.45 63.53 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.108 -1.071 . . . . 50.0 108.108 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.71 -18.82 21.89 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 116.262 -2.025 . . . . 50.0 113.718 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -88.66 -36.62 16.13 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 111.917 0.34 . . . . 50.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -116.09 149.45 38.94 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 114.328 1.233 . . . . 50.0 114.328 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -79.63 -58.07 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.88 -1.054 . . . . 50.0 112.037 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.8 m -98.0 21.56 10.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 116.124 1.898 . . . . 50.0 116.124 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 54.4 p -134.43 159.47 40.97 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.158 -0.682 . . . . 50.0 109.158 175.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -138.15 176.27 8.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.487 -0.778 . . . . 50.0 110.767 -172.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -107.85 144.93 34.37 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 104.116 -2.55 . . . . 50.0 104.116 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -130.13 140.2 50.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 106.18 -1.785 . . . . 50.0 106.18 178.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -120.69 133.05 55.38 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.507 -1.294 . . . . 25.0 107.507 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 109.48 4.47 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.3 36.39 26.96 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.645 0.736 . . . . 25.0 110.635 -177.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.29 -5.5 59.65 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 114.788 0.675 . . . . 25.0 114.788 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 mmt85 -84.15 148.93 26.51 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.251 -1.389 . . . . 50.0 107.251 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 131.46 52.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.963 -0.384 . . . . 50.0 109.963 -177.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -123.54 139.42 54.03 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 107.958 -1.126 . . . . 50.0 107.958 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -119.82 111.71 18.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.375 -1.713 . . . . 50.0 106.375 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -140.27 168.19 20.39 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.902 -0.407 . . . . 50.0 109.902 -173.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.1 p -112.2 159.5 18.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.088 0.774 . . . . 50.0 113.088 -176.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.86 90.12 50.2 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 105.434 -2.062 . . . . 50.0 105.434 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -79.79 -89.17 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 N-CA-C 117.053 1.905 . . . . 50.0 117.053 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.495 ' HG1' ' H ' ' A' ' 38' ' ' THR . 1.2 p -77.23 115.13 16.76 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.695 1.369 . . . . 25.0 114.695 -169.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 1.01 50.04 Favored Glycine 0 CA--C 1.519 0.304 0 N-CA-C 115.23 0.852 . . . . 25.0 115.23 174.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -103.71 134.31 47.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.795 0.331 . . . . 25.0 110.482 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.3 m -131.6 147.17 32.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.138 0.494 . . . . 50.0 110.12 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -80.61 135.83 36.13 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.629 -0.508 . . . . 50.0 109.629 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.6 t -109.45 101.54 10.49 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 107.866 -1.161 . . . . 50.0 107.866 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.37 -27.82 67.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.531 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 p -70.03 -41.26 74.48 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.224 0.453 . . . . 50.0 112.224 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.6 p -96.74 -10.47 26.75 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 -175.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mptt 66.4 31.11 8.45 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.183 0.993 . . . . 50.0 109.232 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.16 163.04 27.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.635 -0.711 . . . . 25.0 109.441 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.7 t -106.87 138.69 42.56 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 104.162 -2.533 . . . . 50.0 104.162 173.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -141.0 164.36 30.48 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.749 -0.463 . . . . 25.0 109.749 -174.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.2 t90 -71.54 147.45 47.67 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.667 -1.234 . . . . 50.0 107.667 175.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -61.95 122.75 16.25 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.249 -0.649 . . . . 50.0 109.249 178.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.89 -9.67 84.1 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 115.193 0.837 . . . . 25.0 115.193 -175.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.0 tp -83.8 107.25 16.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.956 0.878 . . . . 50.0 109.824 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.22 125.41 30.18 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.287 -1.005 . . . . 50.0 108.287 -177.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.23 17.66 1.58 Allowed 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 121.471 1.447 . . . . 50.0 113.898 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.505 -0.755 0 CA-C-O 118.368 -0.825 . . . . 50.0 109.512 -177.42 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 118.832 -0.982 . . . . 25.0 111.379 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -146.8 151.85 43.16 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 105.158 -2.164 . . . . 25.0 105.158 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.13 111.19 2.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 116.015 -2.19 . . . . 25.0 112.069 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.8 p -60.32 -23.65 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.286 0.565 . . . . 25.0 112.219 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -59.4 -33.49 71.28 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.914 0.709 . . . . 50.0 112.914 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 t -105.62 -11.38 16.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.287 0.565 . . . . 25.0 111.403 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -71.95 132.2 44.0 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 107.93 -1.137 . . . . 50.0 107.93 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.35 14.89 77.8 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.906 -0.664 . . . . 25.0 111.904 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -110.24 143.59 40.17 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.156 -0.683 . . . . 50.0 109.156 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.1 152.62 36.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 104.351 -2.463 . . . . 25.0 104.351 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -68.01 149.47 49.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.055 -0.72 . . . . 50.0 109.055 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.48 -176.11 21.61 Favored Glycine 0 N--CA 1.459 0.216 0 N-CA-C 110.88 -0.888 . . . . 50.0 110.88 -177.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.3 mt -94.71 145.51 24.8 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.88 0.84 . . . . 50.0 110.32 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -127.92 150.32 73.18 Favored Pre-proline 0 C--O 1.238 0.482 0 CA-C-N 116.496 -0.32 . . . . 50.0 111.245 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.49 148.97 74.13 Favored 'Trans proline' 0 C--N 1.352 0.724 0 N-CA-C 114.127 0.78 . . . . 50.0 114.127 -178.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.6 p-10 -102.71 150.54 37.8 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 114.869 -1.06 . . . . 50.0 111.448 -173.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.01 -30.0 7.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 N-CA-C 116.578 1.722 . . . . 50.0 116.578 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -78.34 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.931 0.787 . . . . 50.0 112.243 -176.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 34.43 -120.12 0.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.828 1.251 . . . . 50.0 113.262 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.6 tpt180 -155.82 -56.99 0.09 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.789 0.662 . . . . 50.0 112.789 177.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.1 m -153.68 39.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.723 -1.214 . . . . 50.0 107.723 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 p -137.93 157.27 46.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.489 -1.3 . . . . 50.0 107.489 -174.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.42 175.9 11.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.398 -0.819 . . . . 75.0 108.88 -167.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -98.56 154.32 18.0 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.615 -0.883 . . . . 50.0 108.615 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -139.81 131.85 27.9 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.425 -1.324 . . . . 50.0 107.425 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -110.28 134.33 52.36 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 106.144 -1.798 . . . . 25.0 106.144 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.09 126.89 11.79 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.36 31.35 14.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.545 0.738 . . . . 25.0 111.895 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.16 69.75 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 115.434 0.934 . . . . 25.0 115.434 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -112.26 149.96 31.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 118.218 1.009 . . . . 50.0 108.483 177.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.95 133.65 33.92 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.226 0.824 . . . . 50.0 113.226 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -117.33 146.64 43.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.463 -2.421 . . . . 50.0 104.463 165.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -117.23 131.58 56.82 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.562 -2.755 . . . . 50.0 103.562 169.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -136.88 169.41 17.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.6 0.593 . . . . 50.0 112.6 -168.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -136.31 157.79 45.96 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 101.082 -3.674 . . . . 50.0 101.082 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.8 m -106.45 108.3 61.57 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 103.9 -2.63 . . . . 50.0 103.9 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.35 -51.38 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.482 -1.878 . . . . 50.0 116.917 -164.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -105.75 114.47 28.65 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 115.663 1.727 . . . . 25.0 115.663 -172.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.69 4.04 37.55 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 117.66 1.824 . . . . 25.0 117.66 167.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -118.65 146.69 44.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.462 0.631 . . . . 25.0 111.117 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.07 151.04 33.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.069 -1.086 . . . . 50.0 108.069 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -80.32 118.89 22.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.343 0.592 . . . . 50.0 111.101 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.1 t -95.97 105.85 17.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.818 -1.179 . . . . 50.0 107.818 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -62.35 -28.88 70.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.528 0.566 . . . . 25.0 112.528 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -71.73 -33.48 68.75 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.936 -0.306 . . . . 50.0 111.148 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 51.9 t -84.6 -23.13 29.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 25.0 111.99 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 60.23 30.35 19.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 108.399 -0.963 . . . . 50.0 108.399 -170.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 10.4 p -143.3 165.04 28.58 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.241 -0.89 . . . . 25.0 108.851 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.45 136.47 33.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.706 -1.59 . . . . 50.0 106.706 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 34.0 p -121.16 158.9 26.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.201 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 -62.81 132.57 52.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.861 -1.163 . . . . 50.0 107.861 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -74.99 122.37 23.39 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.549 -0.46 . . . . 50.0 110.933 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.71 162.5 11.96 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 108.225 -1.95 . . . . 25.0 108.225 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.1 142.04 47.19 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 106.927 -1.508 . . . . 50.0 106.927 178.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.7 t -85.98 113.1 49.92 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 108.336 -0.987 . . . . 50.0 108.336 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -90.56 6.68 3.91 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 N-CA-C 116.34 1.631 . . . . 50.0 116.34 -172.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 117.996 -1.002 . . . . 50.0 109.511 -177.517 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 CA-C-O 118.346 -1.252 . . . . 25.0 111.477 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.32 153.26 81.6 Favored Pre-proline 0 N--CA 1.471 0.577 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -59.51 133.51 52.35 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.065 1.141 . . . . 25.0 115.065 -174.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.41 -15.94 61.46 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 122.024 0.916 . . . . 25.0 111.704 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.41 -40.69 71.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.513 -1.221 . . . . 50.0 111.684 173.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.4 t -114.02 -3.82 13.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.521 0.563 . . . . 25.0 112.521 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -63.29 117.68 6.95 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 120.534 -1.354 . . . . 50.0 109.473 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.95 17.39 78.5 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 116.556 -0.293 . . . . 25.0 113.669 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -91.89 145.41 24.57 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.755 -0.831 . . . . 50.0 108.755 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.37 148.51 51.53 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 106.862 -1.533 . . . . 25.0 106.862 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -68.24 144.25 54.97 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.975 -0.75 . . . . 50.0 108.975 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.63 -177.1 21.48 Favored Glycine 0 C--O 1.242 0.633 0 N-CA-C 109.765 -1.334 . . . . 50.0 109.765 -176.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.9 mt -96.66 151.8 19.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.264 1.03 . . . . 50.0 112.092 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -132.01 153.45 81.37 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 114.869 -1.059 . . . . 50.0 110.21 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.6 143.44 38.07 Favored 'Trans proline' 0 C--N 1.354 0.851 0 N-CA-C 116.11 1.542 . . . . 50.0 116.11 -174.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -88.73 158.61 47.69 Favored Pre-proline 0 CA--C 1.555 1.167 0 CA-C-N 114.877 -1.056 . . . . 50.0 111.539 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.62 -18.71 3.02 Favored 'Trans proline' 0 C--N 1.353 0.813 0 N-CA-C 118.927 2.626 . . . . 50.0 118.927 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -133.95 -59.77 0.83 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 117.124 2.268 . . . . 50.0 117.124 -172.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -70.38 161.46 30.43 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 114.463 1.283 . . . . 50.0 114.463 -167.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -64.81 -41.97 95.38 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 115.654 1.724 . . . . 50.0 115.654 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.9 m -129.34 3.35 5.14 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.118 1.895 . . . . 50.0 116.118 -173.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.4 p -77.71 165.29 24.41 Favored 'General case' 0 C--O 1.212 -0.874 0 O-C-N 121.208 -0.933 . . . . 50.0 110.122 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -148.89 168.69 22.34 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.214 1.007 . . . . 50.0 111.107 177.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -100.98 153.92 19.12 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.882 -2.636 . . . . 50.0 103.882 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.9 t -140.63 149.07 41.83 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 106.785 -1.561 . . . . 50.0 106.785 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m -123.79 129.38 50.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 105.612 -1.995 . . . . 25.0 105.612 176.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.2 119.54 14.74 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.283 -1.006 . . . . 25.0 108.283 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.39 35.38 17.22 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 123.45 0.7 . . . . 25.0 111.965 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.88 14.38 78.47 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.578 0.591 . . . . 25.0 114.578 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -109.48 143.96 38.39 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.035 -1.098 . . . . 50.0 108.035 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.57 137.7 37.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.765 0.793 . . . . 50.0 112.684 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -128.95 136.16 49.99 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 106.355 -1.72 . . . . 50.0 106.355 166.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -125.09 113.0 17.16 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 103.891 -2.633 . . . . 50.0 103.891 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -137.14 162.58 33.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.082 0.467 . . . . 50.0 111.418 -170.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -108.36 149.85 28.13 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.162 -0.681 . . . . 50.0 109.162 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.04 120.98 47.17 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 103.322 -2.844 . . . . 50.0 103.322 175.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.45 -84.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 N-CA-C 118.19 2.342 . . . . 50.0 118.19 -165.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.3 m -97.53 114.96 26.95 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.896 1.813 . . . . 25.0 115.896 -169.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.74 26.37 69.6 Favored Glycine 0 C--O 1.221 -0.673 0 N-CA-C 116.436 1.335 . . . . 25.0 116.436 170.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.64 161.97 17.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.083 0.942 . . . . 25.0 111.311 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -138.83 171.35 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 106.583 -1.636 . . . . 50.0 106.583 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -101.69 137.5 39.92 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.921 0.782 . . . . 50.0 110.007 177.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.9 t -116.82 108.17 15.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 122.129 0.966 . . . . 50.0 111.076 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -65.41 -24.28 67.16 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 113.112 0.782 . . . . 25.0 113.112 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -66.61 -40.32 88.76 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.137 -0.352 . . . . 50.0 111.07 -176.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 p -103.89 -7.83 20.16 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.595 -0.442 . . . . 25.0 111.8 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm 62.56 35.45 14.45 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.659 0.783 . . . . 50.0 110.266 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.54 160.75 28.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.49 0.662 . . . . 25.0 110.635 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 43.8 t -86.27 128.2 34.88 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.122 -3.288 . . . . 50.0 102.122 168.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.7 p -126.92 163.97 22.48 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 122.581 0.352 . . . . 25.0 111.363 -172.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -65.44 146.84 54.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.895 0.379 . . . . 50.0 111.636 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -64.17 -28.99 70.13 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 112.863 0.69 . . . . 50.0 112.863 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 91.36 -3.21 79.23 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 115.206 0.842 . . . . 25.0 115.206 175.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.49 121.16 14.26 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.735 0.768 . . . . 50.0 111.938 178.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.16 125.18 28.42 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 106.316 -1.735 . . . . 50.0 106.316 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -85.4 -7.65 8.8 Favored 'Trans proline' 0 C--N 1.347 0.453 0 N-CA-C 116.284 1.609 . . . . 50.0 116.284 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 . . . . . 0 C--O 1.247 0.938 0 N-CA-C 109.579 -0.526 . . . . 50.0 109.579 -178.597 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.012 0 CA-C-O 119.206 -0.775 . . . . 25.0 111.62 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.2 t -152.05 156.26 33.91 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 104.384 -2.45 . . . . 25.0 104.384 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -60.95 143.67 99.4 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 116.569 -1.821 . . . . 25.0 113.377 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -67.29 -20.14 65.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.797 0.808 . . . . 25.0 109.806 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.71 -36.71 70.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.083 -0.962 . . . . 50.0 111.912 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.72 -0.99 21.42 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.853 0.686 . . . . 25.0 112.853 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -74.53 128.64 36.06 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 121.612 -0.68 . . . . 50.0 109.302 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 76.59 22.18 73.17 Favored Glycine 0 C--O 1.227 -0.288 0 C-N-CA 120.964 -0.636 . . . . 25.0 112.881 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -113.44 148.15 36.46 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.892 -0.781 . . . . 50.0 108.892 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.72 31.02 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.39 142.83 56.6 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.877 -0.786 . . . . 50.0 108.877 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.75 -174.22 22.76 Favored Glycine 0 C--O 1.229 -0.156 0 C-N-CA 121.21 -0.519 . . . . 50.0 113.122 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -96.67 148.83 22.47 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.593 0.357 . . . . 50.0 110.332 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -131.08 148.19 69.28 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-N 116.028 -0.533 . . . . 50.0 111.381 -176.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.12 147.45 60.6 Favored 'Trans proline' 0 C--N 1.351 0.708 0 N-CA-C 113.656 0.599 . . . . 50.0 113.656 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -121.89 150.81 56.77 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 114.965 -1.016 . . . . 50.0 111.259 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -86.12 -18.85 3.34 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 N-CA-C 117.712 2.158 . . . . 50.0 117.712 -174.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -117.16 -58.62 2.04 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 116.453 2.02 . . . . 50.0 116.453 -168.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.557 ' HB3' ' HG ' ' A' ' 22' ' ' SER . 38.4 mp0 -68.3 150.17 48.55 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.202 0.525 . . . . 50.0 111.865 -173.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.16 -65.39 1.02 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-O 121.505 0.669 . . . . 50.0 111.555 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -95.32 24.56 4.96 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.565 0.95 . . . . 50.0 113.565 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.557 ' HG ' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -145.06 162.04 37.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.525 -1.287 . . . . 50.0 107.525 179.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.6 -177.85 6.63 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.298 -1.001 . . . . 75.0 108.298 -163.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -101.82 156.84 17.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.59 -1.633 . . . . 50.0 106.59 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.0 t -143.75 145.6 32.51 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 107.826 -1.176 . . . . 50.0 107.826 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 t -131.73 130.88 42.51 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.25 -1.019 . . . . 25.0 108.25 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.13 123.22 12.11 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.178 -1.045 . . . . 25.0 108.178 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.48 34.39 18.21 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.61 0.764 . . . . 25.0 112.444 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.59 13.35 82.03 Favored Glycine 0 C--O 1.237 0.342 0 C-N-CA 121.217 -0.516 . . . . 25.0 113.862 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -108.26 140.12 41.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.767 -1.198 . . . . 50.0 107.767 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 41.5 tp -87.77 128.65 35.32 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.315 0.384 . . . . 50.0 110.262 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -122.02 140.78 52.08 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 104.421 -2.437 . . . . 50.0 104.421 169.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -114.0 122.15 46.04 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 102.989 -2.967 . . . . 50.0 102.989 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -136.42 164.56 27.87 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 113.739 1.014 . . . . 50.0 113.739 -166.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.3 p -123.37 160.83 25.94 Favored 'General case' 0 C--N 1.32 -0.7 1 N-CA-C 100.191 -4.003 . . . . 50.0 100.191 164.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -101.55 123.5 44.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 106.021 -1.844 . . . . 50.0 106.021 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.43 -55.43 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 115.435 -2.576 . . . . 50.0 116.492 -170.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.58 85.0 6.6 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 115.389 1.625 . . . . 25.0 115.389 -174.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.53 -9.51 0.85 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 118.284 2.073 . . . . 25.0 118.284 168.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 31.6 mt -81.07 155.92 26.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 118.163 0.981 . . . . 25.0 113.11 -166.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.4 m -124.14 151.82 29.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 107.449 -1.315 . . . . 50.0 107.449 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -75.25 126.64 31.44 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.404 -0.81 . . . . 50.0 109.334 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.4 t -109.94 109.49 20.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.403 -0.962 . . . . 50.0 108.403 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.83 -14.01 60.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.723 1.008 . . . . 25.0 113.723 -176.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.5 p -71.48 -47.86 52.89 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.299 -0.876 . . . . 50.0 110.249 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.2 p -92.78 -6.66 48.48 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.772 1.027 . . . . 25.0 113.772 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 59.94 35.16 21.65 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.108 -1.441 . . . . 50.0 107.108 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -142.91 168.03 20.67 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.584 -0.734 . . . . 25.0 110.389 -172.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.73 131.27 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.101 -1.074 . . . . 50.0 108.101 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.86 152.96 43.32 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.699 0.285 . . . . 25.0 110.369 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.0 t90 -72.48 146.38 46.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 107.35 -1.352 . . . . 50.0 107.35 174.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -79.82 84.12 5.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.024 0.44 . . . . 50.0 111.392 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -91.65 32.91 5.05 Favored Glycine 0 C--O 1.227 -0.284 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.335 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 tp -74.45 106.74 6.2 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.081 0.467 . . . . 50.0 110.19 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.24 121.91 83.58 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 107.319 -1.363 . . . . 50.0 107.319 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -84.97 7.9 4.93 Favored 'Trans proline' 0 C--N 1.349 0.58 0 N-CA-C 114.38 0.877 . . . . 50.0 114.38 -177.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.245 0.852 0 CA-C-O 117.298 -1.334 . . . . 50.0 110.889 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.975 0 CA-C-O 119.733 -0.481 . . . . 25.0 112.249 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.8 t -65.67 139.11 96.92 Favored Pre-proline 0 N--CA 1.478 0.959 0 CA-C-N 117.273 0.537 . . . . 25.0 110.34 177.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.49 119.73 6.84 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 116.466 -1.889 . . . . 25.0 115.073 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p -76.63 -1.98 30.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.881 0.848 . . . . 25.0 109.985 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -56.27 -31.34 63.51 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.302 -0.863 . . . . 50.0 111.384 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.6 t -110.98 -16.28 13.56 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.475 0.917 . . . . 25.0 113.475 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.81 126.14 28.09 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 119.297 -0.961 . . . . 50.0 108.498 177.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 10.88 72.34 Favored Glycine 0 CA--C 1.521 0.454 0 CA-C-N 115.544 -0.753 . . . . 25.0 113.544 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -106.91 149.39 27.51 Favored 'General case' 0 CA--C 1.504 -0.813 0 O-C-N 121.448 -1.03 . . . . 50.0 108.392 178.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.48 151.43 41.05 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 105.83 -1.915 . . . . 25.0 105.83 176.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.78 150.36 49.23 Favored 'General case' 0 C--O 1.246 0.904 0 N-CA-C 107.578 -1.268 . . . . 50.0 107.578 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.0 179.59 19.13 Favored Glycine 0 C--O 1.242 0.612 0 N-CA-C 110.097 -1.201 . . . . 50.0 110.097 -175.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.2 mt -101.33 149.44 24.03 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 112.865 0.691 . . . . 50.0 112.865 -177.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -132.79 144.12 51.57 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 107.622 -1.251 . . . . 50.0 107.622 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.16 149.19 45.59 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 117.32 -1.32 . . . . 50.0 114.249 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -96.3 118.27 65.58 Favored Pre-proline 0 C--O 1.216 -0.702 0 N-CA-C 108.586 -0.894 . . . . 50.0 108.586 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -79.92 -13.18 13.04 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 115.415 1.275 . . . . 50.0 115.415 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -87.41 -42.73 12.62 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.151 0.501 . . . . 50.0 111.167 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -97.94 155.32 17.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.16 -0.927 . . . . 50.0 112.689 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -69.2 -46.85 66.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.521 1.674 . . . . 50.0 115.521 -177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -130.44 20.75 5.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.742 1.756 . . . . 50.0 115.742 -167.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 63.1 p -111.01 164.15 13.11 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.122 -1.066 . . . . 50.0 108.122 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -135.13 166.58 22.75 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 122.128 0.966 . . . . 50.0 108.591 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -97.6 145.78 25.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 101.209 -3.626 . . . . 50.0 101.209 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -135.76 138.44 42.66 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.396 -1.335 . . . . 50.0 107.396 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.4 m -114.13 123.95 50.88 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.825 -0.805 . . . . 25.0 108.825 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.98 113.62 13.62 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.81 38.54 26.88 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.913 0.758 . . . . 25.0 109.383 -177.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.36 15.2 74.85 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 115.565 0.986 . . . . 25.0 115.565 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -113.57 149.18 34.85 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.694 -0.854 . . . . 50.0 108.694 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -93.3 130.44 39.03 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 113.674 0.99 . . . . 50.0 113.674 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.97 137.83 53.23 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 106.916 -1.513 . . . . 50.0 106.916 169.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -117.65 108.98 16.09 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 105.332 -2.099 . . . . 50.0 105.332 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.73 165.4 27.39 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.188 -0.32 . . . . 50.0 110.786 -168.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.82 164.11 11.82 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.849 0.833 . . . . 50.0 111.623 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.18 95.8 38.2 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 104.5 -2.407 . . . . 50.0 104.5 167.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -91.83 -119.13 0.01 OUTLIER 'Trans proline' 0 C--O 1.25 1.12 0 C-N-CA 120.435 0.757 . . . . 50.0 113.211 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.445 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.9 OUTLIER -64.49 142.61 58.36 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 121.115 -0.99 . . . . 25.0 112.185 -178.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 79.27 -7.6 51.67 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 116.947 1.539 . . . . 25.0 116.947 173.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.6 mt -131.83 142.69 49.79 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.146 0.973 . . . . 25.0 111.773 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.8 149.71 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 108.395 -0.965 . . . . 50.0 108.395 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -90.1 132.39 35.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.657 0.742 . . . . 50.0 112.631 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.8 t -113.32 102.64 10.54 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 121.726 0.774 . . . . 50.0 109.737 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -63.74 -27.75 69.41 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 114.385 1.254 . . . . 25.0 114.385 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 p -67.7 -35.67 79.23 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.053 0.39 . . . . 50.0 112.053 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.3 p -104.83 -7.82 19.16 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.079 0.4 . . . . 25.0 112.079 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm 59.43 44.76 14.57 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.087 1.355 . . . . 50.0 113.069 -174.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.02 168.08 16.56 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.02 -0.991 . . . . 25.0 110.998 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.23 132.3 53.22 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 103.119 -2.919 . . . . 50.0 103.119 168.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 77.1 p -118.69 158.5 25.39 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.76 0.791 . . . . 25.0 111.314 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -70.02 137.42 51.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.098 -0.955 . . . . 50.0 109.354 178.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -99.5 105.23 17.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.066 0.46 . . . . 50.0 111.836 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -172.1 -35.34 0.03 OUTLIER Glycine 0 C--O 1.209 -1.46 0 C-N-CA 120.912 -0.661 . . . . 25.0 114.117 -179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 126.14 30.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 118.0 0.9 . . . . 50.0 110.862 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.2 t -130.62 117.88 17.7 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 109.901 -0.407 . . . . 50.0 109.901 176.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -85.43 -3.45 9.33 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 121.58 1.52 . . . . 50.0 114.365 -176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? . . . . . 0 CA--C 1.511 -0.541 0 N-CA-C 106.679 -1.6 . . . . 50.0 106.679 -178.8 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.036 0 CA-C-O 118.788 -1.007 . . . . 25.0 111.389 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.3 t -138.31 143.44 38.89 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 106.184 -1.784 . . . . 25.0 106.184 178.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.07 -14.26 18.95 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 117.521 -1.186 . . . . 25.0 114.043 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.6 p 48.03 26.23 0.95 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.136 1.161 . . . . 25.0 114.136 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -64.53 -45.42 87.23 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 113.959 1.096 . . . . 50.0 113.959 -173.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.34 -7.31 13.98 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.563 0.697 . . . . 25.0 111.979 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -70.85 122.51 20.05 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 116.154 -0.476 . . . . 50.0 109.83 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.32 19.95 68.01 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.173 -0.537 . . . . 25.0 113.041 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -119.48 149.86 41.19 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 117.171 0.486 . . . . 50.0 111.097 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 153.27 42.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.245 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -70.45 148.41 48.35 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.652 -0.704 . . . . 50.0 110.353 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.23 -179.41 23.26 Favored Glycine 0 CA--C 1.517 0.169 0 N-CA-C 109.942 -1.263 . . . . 50.0 109.942 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -98.75 143.93 28.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.286 1.043 . . . . 50.0 111.108 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.98 148.2 61.95 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.665 -0.495 . . . . 50.0 109.665 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.35 148.86 55.84 Favored 'Trans proline' 0 C--N 1.35 0.614 0 N-CA-C 115.249 1.211 . . . . 50.0 115.249 -175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -84.07 154.77 64.05 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-N 114.408 -1.269 . . . . 50.0 110.38 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -81.48 -21.15 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 N-CA-C 115.981 1.493 . . . . 50.0 115.981 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 -29.67 0.49 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.3 1.593 . . . . 50.0 115.3 -169.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -74.47 -178.51 3.56 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 124.482 1.113 . . . . 50.0 112.349 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -134.96 -56.05 0.82 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.498 -0.751 . . . . 50.0 111.549 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -79.87 -2.84 45.36 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.268 0.84 . . . . 50.0 113.268 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.5 p -130.36 154.58 47.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.437 . . . . 50.0 110.529 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -177.93 6.07 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.279 -1.008 . . . . 75.0 108.279 -170.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -106.04 158.87 16.49 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.973 -1.491 . . . . 50.0 106.973 176.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.1 t -142.73 153.41 43.3 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.091 -1.448 . . . . 50.0 107.091 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.46 128.29 46.73 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 104.46 -2.422 . . . . 25.0 104.46 175.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.85 118.76 11.81 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.97 -1.493 . . . . 25.0 106.97 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.71 33.72 21.91 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.801 0.84 . . . . 25.0 110.352 -173.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.15 7.94 68.46 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 114.619 0.608 . . . . 25.0 114.619 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -101.46 153.26 19.86 Favored 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 121.863 -0.786 . . . . 50.0 108.98 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.98 128.8 33.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.153 -0.476 . . . . 50.0 110.144 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.33 149.52 52.34 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.264 -2.495 . . . . 50.0 104.264 169.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -113.97 146.18 40.49 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 103.125 -2.917 . . . . 50.0 103.125 171.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -129.16 164.7 22.81 Favored 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 109.144 -0.687 . . . . 50.0 109.144 -171.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.0 p -146.58 155.03 42.18 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 102.022 -3.325 . . . . 50.0 102.022 171.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -116.76 117.55 37.52 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 103.086 -2.931 . . . . 50.0 103.086 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.86 -87.6 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 117.528 -1.181 . . . . 50.0 114.676 -171.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.4 t -104.07 153.11 21.27 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.565 -0.709 . . . . 25.0 110.874 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -10.48 4.71 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 118.968 2.347 . . . . 25.0 118.968 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -129.31 144.77 51.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 118.09 0.945 . . . . 25.0 109.439 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.9 m -135.47 147.19 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 109.508 -0.553 . . . . 50.0 109.508 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -77.55 130.34 36.81 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.392 -0.818 . . . . 50.0 109.662 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -126.49 122.73 36.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.49 0.662 . . . . 50.0 109.638 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -64.31 -21.72 66.7 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.4 p -67.67 -32.25 72.78 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.784 0.265 . . . . 50.0 111.467 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.9 t -94.11 -21.75 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.438 -0.578 . . . . 25.0 109.438 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.3 tptt 60.32 26.85 16.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.982 -1.008 . . . . 50.0 108.46 -171.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -143.26 171.69 13.76 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.286 -1.324 . . . . 25.0 107.663 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.3 t -88.25 127.06 35.45 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.433 -1.691 . . . . 50.0 106.433 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 41.8 p -112.67 161.52 16.76 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.409 -0.589 . . . . 25.0 109.409 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -67.38 146.71 53.77 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.34 -0.615 . . . . 50.0 109.34 177.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -78.37 70.31 4.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.3 0.572 . . . . 50.0 111.477 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.38 51.8 4.61 Favored Glycine 0 C--O 1.227 -0.343 0 CA-C-N 115.902 -0.59 . . . . 25.0 112.956 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tt -66.82 130.78 44.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.914 -0.402 . . . . 50.0 109.914 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.69 131.8 23.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 105.901 -1.888 . . . . 50.0 105.901 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -85.94 14.61 2.41 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 121.143 1.229 . . . . 50.0 113.647 -177.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.214 -0.898 . . . . 50.0 109.468 -179.138 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.995 0 CA-C-O 118.879 -0.956 . . . . 25.0 111.392 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.6 t -65.96 144.54 98.85 Favored Pre-proline 0 N--CA 1.469 0.507 0 CA-C-N 118.34 1.07 . . . . 25.0 108.943 177.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.06 -25.26 27.4 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 116.378 -1.948 . . . . 25.0 114.012 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.9 p -85.49 -2.93 58.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.263 0.554 . . . . 25.0 111.447 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -58.35 -39.48 79.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.092 0.775 . . . . 50.0 113.092 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.06 2.34 16.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.916 0.71 . . . . 25.0 112.916 -177.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -69.66 123.9 22.58 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.452 -0.573 . . . . 50.0 109.452 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.65 17.93 78.35 Favored Glycine 0 C--O 1.226 -0.37 0 C-N-CA 121.216 -0.516 . . . . 25.0 113.706 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -102.23 145.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-N 117.66 0.73 . . . . 50.0 109.995 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 152.35 44.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.857 -1.065 . . . . 25.0 108.868 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.66 160.39 22.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.667 -0.697 . . . . 50.0 111.899 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.11 -176.55 16.21 Favored Glycine 0 N--CA 1.458 0.143 0 CA-C-N 116.046 -0.525 . . . . 50.0 111.966 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -96.33 151.88 19.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.48 0.657 . . . . 50.0 111.539 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -132.64 147.31 65.04 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 106.094 -1.817 . . . . 50.0 106.094 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.61 146.38 49.09 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 117.368 -1.288 . . . . 50.0 113.528 -175.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -107.59 124.19 35.75 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 116.43 -0.35 . . . . 50.0 110.147 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.71 -15.96 8.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 116.234 1.59 . . . . 50.0 116.234 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -123.24 -47.03 2.03 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 119.554 3.168 . . . . 50.0 119.554 -170.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.36 -65.76 0.51 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 116.273 1.953 . . . . 50.0 116.273 -164.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -172.47 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.985 -0.746 . . . . 50.0 108.985 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.3 p -118.36 14.98 13.88 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.286 -1.746 . . . . 50.0 106.286 175.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 114.251 -1.34 . . . . 50.0 110.374 -178.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -133.32 -179.46 5.52 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.978 -1.119 . . . . 50.0 107.978 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -107.86 145.17 34.05 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.621 -3.103 . . . . 50.0 102.621 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -134.33 143.14 47.51 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 106.609 -1.626 . . . . 50.0 106.609 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.91 127.7 52.1 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 177.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.17 120.59 14.98 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.72 32.25 17.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.645 0.778 . . . . 25.0 111.855 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.2 79.77 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 121.119 -0.562 . . . . 25.0 113.669 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -118.62 148.36 42.79 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.678 -1.23 . . . . 50.0 107.678 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 51.4 tp -91.41 129.17 37.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.53 0.566 . . . . 50.0 112.53 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -120.72 132.56 55.14 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.429 -1.693 . . . . 50.0 106.429 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -113.98 107.34 15.54 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 104.309 -2.478 . . . . 50.0 104.309 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -143.51 169.62 17.36 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.788 -0.449 . . . . 50.0 109.788 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.6 p -117.42 160.07 21.77 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.274 -0.639 . . . . 50.0 109.274 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.53 127.68 55.7 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 107.371 -1.344 . . . . 50.0 107.371 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.83 -55.68 0.25 Allowed 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 116.091 -2.139 . . . . 50.0 117.028 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.677 ' HG1' ' HE1' ' A' ' 51' ' ' TRP . 10.7 t -106.31 143.75 33.99 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.709 -0.619 . . . . 25.0 112.275 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.08 14.39 70.93 Favored Glycine 0 C--O 1.222 -0.597 0 N-CA-C 115.909 1.124 . . . . 25.0 115.909 169.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.3 111.6 0.6 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 118.945 2.943 . . . . 25.0 118.945 -160.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.3 m -145.62 161.49 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 N-CA-C 104.569 -2.382 . . . . 50.0 104.569 165.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -116.05 130.03 56.63 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.678 -0.49 . . . . 50.0 109.678 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.2 t -110.17 114.22 27.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.843 0.83 . . . . 50.0 109.812 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -63.01 -31.35 72.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.386 -0.824 . . . . 25.0 113.118 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 44.4 p -65.57 -32.07 73.46 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.294 0.85 . . . . 50.0 113.294 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 28.3 p -104.51 -5.38 21.62 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.39 -0.226 . . . . 25.0 110.39 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? 52.3 41.25 30.37 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.468 -0.938 . . . . 50.0 108.468 -173.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.4 p -143.15 168.37 19.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.613 -0.722 . . . . 25.0 111.417 -172.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.3 t -86.21 139.93 30.61 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.061 -1.459 . . . . 50.0 107.061 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.9 p -128.02 167.84 16.14 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 105.497 -2.038 . . . . 25.0 105.497 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.677 ' HE1' ' HG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.7 148.66 31.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.243 -1.762 . . . . 50.0 106.243 174.795 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -63.23 140.53 58.88 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.174 -0.676 . . . . 50.0 109.174 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.02 -6.16 68.16 Favored Glycine 0 CA--C 1.52 0.36 0 N-CA-C 115.363 0.905 . . . . 25.0 115.363 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.64 159.0 15.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 118.049 0.924 . . . . 50.0 112.885 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -85.92 136.58 36.27 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 106.356 -1.72 . . . . 50.0 106.356 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -79.26 4.14 6.84 Favored 'Trans proline' 0 C--N 1.351 0.677 0 N-CA-C 114.62 0.969 . . . . 50.0 114.62 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.5 mtp180 . . . . . 0 C--O 1.241 0.616 0 C-N-CA 123.573 0.749 . . . . 50.0 108.981 178.773 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 CA-C-O 119.102 -0.832 . . . . 25.0 111.469 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -64.26 131.27 94.98 Favored Pre-proline 0 N--CA 1.467 0.378 0 CA-C-N 118.183 0.991 . . . . 25.0 111.155 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -74.76 -28.2 9.83 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 116.39 -1.94 . . . . 25.0 113.637 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.4 p -75.83 -21.01 57.72 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 121.228 0.537 . . . . 25.0 112.055 -175.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.466 ' CD1' HD12 ' A' ' 31' ' ' LEU . 77.1 t80 -64.91 -28.85 69.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.353 -0.385 . . . . 50.0 111.913 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -111.31 10.11 21.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.625 -0.262 . . . . 25.0 111.529 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -73.69 138.8 44.93 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.599 -0.889 . . . . 50.0 108.599 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 71.65 17.58 76.65 Favored Glycine 0 C--O 1.227 -0.31 0 C-N-CA 121.027 -0.606 . . . . 25.0 112.733 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -126.33 147.72 49.68 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.125 -0.695 . . . . 50.0 109.125 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.17 156.56 35.76 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -69.94 148.07 49.41 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.744 -1.206 . . . . 50.0 107.744 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.04 -174.39 24.41 Favored Glycine 0 N--CA 1.454 -0.124 0 N-CA-C 110.243 -1.143 . . . . 50.0 110.243 -175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.2 mt -97.64 148.85 22.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.427 0.614 . . . . 50.0 111.347 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -132.13 154.51 81.69 Favored Pre-proline 0 C--O 1.24 0.568 0 N-CA-C 112.111 0.412 . . . . 50.0 112.111 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.07 131.1 27.55 Favored 'Trans proline' 0 C--N 1.357 0.984 0 N-CA-C 114.346 0.864 . . . . 50.0 114.346 -177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.524 ' ND2' ' HG ' ' A' ' 22' ' ' SER . 15.8 p-10 -118.8 150.69 48.92 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 114.541 -1.209 . . . . 50.0 111.562 -172.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.65 -19.44 4.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 N-CA-C 117.3 2.0 . . . . 50.0 117.3 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -79.49 -59.85 2.59 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 116.235 1.939 . . . . 50.0 116.235 -166.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.91 151.24 40.8 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.252 0.464 . . . . 50.0 112.252 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -60.45 -33.2 72.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.766 0.826 . . . . 50.0 111.142 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.449 ' H ' ' HG ' ' A' ' 21' ' ' SER . 40.3 p -85.69 -0.34 54.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.769 -1.105 . . . . 50.0 113.684 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.524 ' HG ' ' ND2' ' A' ' 16' ' ' ASN . 91.2 p -122.46 167.54 13.21 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.437 -0.949 . . . . 50.0 108.437 -178.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -154.83 173.89 15.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.409 0.623 . . . . 50.0 111.764 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -102.83 145.29 29.99 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 102.343 -3.206 . . . . 50.0 102.343 169.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.2 t -135.72 141.62 44.92 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.834 -1.173 . . . . 50.0 107.834 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.2 m -117.11 127.54 54.24 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 105.732 -1.951 . . . . 25.0 105.732 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.68 128.52 23.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.835 -1.913 . . . . 25.0 105.835 177.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.29 28.54 13.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.986 0.914 . . . . 25.0 110.578 -173.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 69.17 23.37 76.23 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 121.202 -0.523 . . . . 25.0 113.799 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.1 mmt-85 -123.82 149.37 45.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 117.855 0.827 . . . . 50.0 109.013 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.466 HD12 ' CD1' ' A' ' 5' ' ' PHE . 51.2 tp -79.42 127.9 32.68 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 114.046 1.128 . . . . 50.0 114.046 -177.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -123.86 131.96 53.67 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.861 -1.903 . . . . 50.0 105.861 167.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -113.98 124.31 51.85 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.202 -1.777 . . . . 50.0 106.202 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -143.49 170.94 14.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.024 -0.361 . . . . 50.0 110.024 -172.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.8 p -121.31 162.79 19.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.321 -0.992 . . . . 50.0 108.321 176.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.5 t -123.14 71.53 44.4 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 106.474 -1.676 . . . . 50.0 106.474 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.27 -27.71 9.36 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 116.201 -2.066 . . . . 50.0 117.277 -164.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.467 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -80.07 86.41 5.53 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.505 1.298 . . . . 25.0 114.505 -175.021 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.98 2.14 29.31 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.312 2.085 . . . . 25.0 118.312 168.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.0 mt -122.69 162.87 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.215 1.007 . . . . 25.0 111.158 -173.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.31 159.82 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.457 -0.338 . . . . 50.0 110.66 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.78 125.89 29.15 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.258 -0.577 . . . . 50.0 110.351 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -107.2 109.72 21.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.862 0.839 . . . . 50.0 109.226 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.29 -20.55 66.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.11 1.152 . . . . 25.0 114.11 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.6 p -70.75 -43.65 68.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.545 0.572 . . . . 50.0 112.545 -177.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 13.9 p -104.5 -6.96 20.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.93 0.344 . . . . 25.0 111.93 -177.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 61.66 39.32 14.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.857 0.863 . . . . 50.0 110.928 -176.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.96 169.14 13.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.577 -0.738 . . . . 25.0 109.505 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.5 t -99.16 122.89 42.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 105.564 -2.013 . . . . 50.0 105.564 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -146.24 173.67 12.02 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.062 0.145 . . . . 25.0 110.676 -173.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -57.17 148.71 21.42 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.94 0.4 . . . . 50.0 111.569 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.61 61.92 3.74 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.628 0.973 . . . . 50.0 113.628 -177.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.2 43.49 79.97 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 115.752 1.061 . . . . 25.0 115.752 173.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.4 tt -66.55 128.55 36.66 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.144 -0.687 . . . . 50.0 109.144 177.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.54 131.85 24.23 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 106.436 -1.69 . . . . 50.0 106.436 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -83.03 5.74 6.24 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 N-CA-C 114.784 1.032 . . . . 50.0 114.784 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? . . . . . 0 C--O 1.242 0.669 0 N-CA-C 106.636 -1.616 . . . . 50.0 106.636 -178.381 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.963 0 CA-C-O 118.717 -1.046 . . . . 25.0 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.1 t 66.26 151.69 0.12 Allowed Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -60.69 -25.05 80.19 Favored 'Trans proline' 0 C--O 1.204 -1.186 0 C-N-CA 116.192 -2.072 . . . . 25.0 116.794 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.03 -2.32 0.31 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 114.234 1.198 . . . . 25.0 114.234 -174.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.27 -37.32 86.82 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 125.02 1.328 . . . . 50.0 114.008 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -104.34 -1.98 26.16 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 118.437 0.562 . . . . 25.0 111.429 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -74.73 127.17 32.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.645 1.212 . . . . 50.0 108.661 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.9 -8.35 70.26 Favored Glycine 0 CA--C 1.546 2.006 0 CA-C-N 113.959 -1.473 . . . . 25.0 113.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -88.44 146.51 25.18 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 122.107 -0.643 . . . . 50.0 110.842 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.97 154.73 35.63 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.074 -1.084 . . . . 25.0 108.074 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -63.5 148.11 49.56 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 109.906 -0.405 . . . . 50.0 109.906 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.36 -169.64 25.37 Favored Glycine 0 C--O 1.211 -1.3 0 N-CA-C 110.485 -1.046 . . . . 50.0 110.485 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.5 mt -115.37 138.19 51.25 Favored 'General case' 0 CA--C 1.488 -1.44 0 O-C-N 120.502 -1.587 . . . . 50.0 110.835 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -124.99 146.45 53.55 Favored Pre-proline 0 C--O 1.218 -0.567 0 C-N-CA 125.198 1.399 . . . . 50.0 108.317 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 151.21 40.96 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 115.998 -2.201 . . . . 50.0 113.901 -171.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -87.37 138.07 32.28 Favored Pre-proline 0 CA--C 1.556 1.21 0 N-CA-C 109.1 -0.704 . . . . 50.0 109.1 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -79.41 -19.79 10.04 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 N-CA-C 116.107 1.541 . . . . 50.0 116.107 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -102.14 -42.38 6.08 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.941 -0.474 . . . . 50.0 111.816 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -106.44 162.16 13.95 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.9 -0.778 . . . . 50.0 108.9 173.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.52 -8.05 10.53 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 116.484 2.031 . . . . 50.0 116.484 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.23 10.36 31.83 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 107.849 -1.167 . . . . 50.0 107.849 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.7 p -121.75 167.31 13.12 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 107.867 -1.16 . . . . 50.0 107.867 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -146.72 169.95 17.98 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.099 -0.955 . . . . 50.0 109.657 -175.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.23 133.86 42.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 104.302 -2.481 . . . . 50.0 104.302 164.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -112.71 135.69 53.16 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.21 -2.145 . . . . 50.0 105.21 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -116.09 125.04 51.85 Favored 'General case' 0 C--O 1.246 0.873 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 174.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.7 124.86 16.37 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 124.243 0.965 . . . . 25.0 108.988 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 51.63 37.1 19.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.021 0.915 . . . . 25.0 111.186 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.37 7.73 64.58 Favored Glycine 0 CA--C 1.543 1.823 0 CA-C-N 115.12 -0.946 . . . . 25.0 115.156 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -108.56 150.67 27.16 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 120.805 -1.409 . . . . 50.0 108.325 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.89 133.88 36.84 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.558 1.318 . . . . 50.0 114.558 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -124.76 149.23 47.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 105.715 -1.957 . . . . 50.0 105.715 171.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -129.13 105.95 8.52 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.803 -1.185 . . . . 50.0 108.09 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.97 175.23 9.73 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 112.743 0.645 . . . . 50.0 112.743 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.7 p -113.08 163.31 14.88 Favored 'General case' 0 C--O 1.206 -1.191 0 O-C-N 123.682 0.614 . . . . 50.0 111.708 177.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.2 88.69 37.96 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 102.136 -3.283 . . . . 50.0 102.136 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -85.09 -66.27 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.139 0 N-CA-C 120.638 3.284 . . . . 50.0 120.638 -167.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.491 ' H ' ' HG1' ' A' ' 38' ' ' THR . 0.8 OUTLIER -86.54 117.81 25.55 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.045 -1.659 . . . . 25.0 112.703 -170.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.24 17.91 79.66 Favored Glycine 0 CA--C 1.55 2.273 0 CA-C-O 117.658 -1.634 . . . . 25.0 113.271 174.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 71.1 mt -138.13 153.19 49.26 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 114.785 1.402 . . . . 25.0 114.785 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.82 166.96 18.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 N-CA-C 107.545 -1.28 . . . . 50.0 107.545 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -101.4 129.7 47.47 Favored 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 116.236 -0.438 . . . . 50.0 110.762 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.6 t -119.92 112.01 18.66 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 123.222 1.487 . . . . 50.0 109.895 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.02 -23.88 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.935 -1.029 . . . . 25.0 112.455 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.2 p -68.52 -29.89 68.58 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 118.964 -0.541 . . . . 50.0 111.583 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.37 -6.72 22.71 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.5 tptt 59.29 33.65 22.63 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 123.124 1.44 . . . . 50.0 108.963 -177.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 2.6 p -145.89 167.49 23.14 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 113.647 -1.615 . . . . 25.0 113.935 -170.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.1 t -85.79 136.31 33.37 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 115.15 -0.932 . . . . 50.0 109.377 175.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.9 p -131.39 170.64 14.38 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.355 -0.98 . . . . 25.0 108.355 -175.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -76.29 140.15 41.4 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.129 0.972 . . . . 50.0 112.423 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -62.76 -50.29 71.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.952 0.882 . . . . 50.0 111.702 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 155.66 -122.23 1.18 Allowed Glycine 0 C--O 1.242 0.624 0 CA-C-O 121.904 0.724 . . . . 25.0 113.265 -174.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.98 161.05 14.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.926 -0.749 . . . . 50.0 111.814 -176.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.1 t -109.74 126.39 29.2 Favored Pre-proline 0 N--CA 1.48 1.068 0 N-CA-C 104.226 -2.509 . . . . 50.0 104.226 176.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -82.15 -11.08 11.12 Favored 'Trans proline' 0 C--O 1.209 -0.95 0 N-CA-C 116.709 1.773 . . . . 50.0 116.709 -173.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 . . . . . 0 CA--C 1.499 -0.988 0 N-CA-C 105.165 -2.161 . . . . 50.0 105.165 -175.49 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 p . . . . . 0 C--O 1.222 -0.369 0 N-CA-C 112.632 0.604 . . . . 25.0 112.632 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -54.5 -37.61 65.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.054 1.501 . . . . 25.0 115.054 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.44 3.88 15.1 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.939 0.4 . . . . 25.0 112.05 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.56 122.09 19.88 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.631 -0.668 . . . . 25.0 109.812 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.64 -1.45 82.84 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 121.078 -0.582 . . . . 25.0 113.643 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -82.52 143.9 30.77 Favored 'General case' 0 CA--C 1.508 -0.664 0 O-C-N 122.275 -0.544 . . . . 25.0 111.61 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.76 158.47 32.32 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 171.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -67.23 175.3 2.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.881 -0.599 . . . . 25.0 111.404 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.15 -178.86 19.32 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 110.73 -0.948 . . . . 25.0 110.73 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.424 HD22 ' CD2' ' A' ' 23' ' ' PHE . 45.9 mt -100.88 149.28 24.03 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.135 0.493 . . . . 25.0 112.192 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -130.07 151.68 78.76 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.378 0.671 . . . . 25.0 109.676 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.31 146.47 63.12 Favored 'Trans proline' 0 C--N 1.352 0.752 0 N-CA-C 115.11 1.158 . . . . 25.0 115.11 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -90.77 155.87 45.18 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 114.655 -1.157 . . . . 25.0 110.71 -176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -89.87 -17.94 1.58 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 N-CA-C 117.743 2.17 . . . . 25.0 117.743 -173.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -137.0 -50.42 0.65 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 117.3 2.333 . . . . 25.0 117.3 -168.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -74.41 164.08 27.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -171.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -65.76 -44.34 86.16 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 115.357 1.614 . . . . 25.0 115.357 -176.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 m -143.43 35.29 1.32 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.046 1.499 . . . . 25.0 115.046 -174.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 89.7 p -98.05 171.31 8.33 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 34' ' ' GLN . 14.5 p90 -147.48 172.66 13.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.471 0.653 . . . . 25.0 109.719 178.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -105.95 148.42 27.67 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 103.761 -2.681 . . . . 25.0 103.761 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -134.16 139.99 46.25 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.874 -1.899 . . . . 25.0 105.874 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -116.15 129.57 56.38 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.48 -0.933 . . . . 25.0 108.48 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.97 114.54 9.82 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.813 -1.18 . . . . 25.0 107.813 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.25 38.52 27.86 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.212 0.605 . . . . 25.0 112.168 -178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.63 1.91 73.41 Favored Glycine 0 N--CA 1.465 0.593 0 N-CA-C 115.316 0.886 . . . . 25.0 115.316 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -98.52 148.02 24.18 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.1 tp -100.98 132.81 46.22 Favored 'General case' 0 C--O 1.218 -0.576 0 O-C-N 123.799 0.687 . . . . 25.0 111.539 -176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -119.67 142.73 48.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.688 -1.597 . . . . 25.0 106.688 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -122.45 115.76 22.79 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.056 -2.201 . . . . 25.0 105.056 174.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.437 ' HB2' ' CE2' ' A' ' 23' ' ' PHE . 78.2 mt-30 -139.79 171.04 14.79 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.646 -0.502 . . . . 25.0 109.646 -171.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 59.9 p -110.66 155.72 22.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.41 0.893 . . . . 25.0 113.41 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.19 89.94 22.38 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 105.292 -2.114 . . . . 25.0 105.292 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.49 -52.33 0.05 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 0 N-CA-C 118.846 2.595 . . . . 25.0 118.846 -166.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 m -104.24 106.68 17.26 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.32 1.6 . . . . 25.0 115.32 -170.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.88 -4.89 14.34 Favored Glycine 0 N--CA 1.467 0.703 0 N-CA-C 114.318 0.487 . . . . 25.0 114.318 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.26 136.47 34.52 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.226 0.61 . . . . 25.0 110.868 -175.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.7 m -131.5 149.6 33.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 108.528 -0.916 . . . . 25.0 108.528 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -80.49 138.64 36.58 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.652 -0.499 . . . . 25.0 109.652 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -119.37 113.44 20.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.976 0.893 . . . . 25.0 110.086 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.8 -19.91 65.38 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.154 0.798 . . . . 25.0 113.154 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.2 p -75.18 -36.02 61.5 Favored 'General case' 0 C--O 1.219 -0.533 0 O-C-N 122.005 -0.435 . . . . 25.0 111.722 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.1 p -102.07 -7.78 21.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.635 0.976 . . . . 25.0 113.635 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 mptt 57.82 36.9 26.84 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 106.995 -1.483 . . . . 25.0 106.995 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.3 p -140.9 166.49 24.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 25.0 108.872 -174.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.1 t -113.98 137.27 51.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.333 -2.099 . . . . 25.0 105.333 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.1 t -141.0 160.23 40.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.136 0.493 . . . . 25.0 109.737 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 . . . . . 0 C--N 1.321 -0.638 0 N-CA-C 107.949 -1.13 . . . . 25.0 107.949 177.472 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.362 0 N-CA-C 116.372 1.989 . . . . 25.0 116.372 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.85 -33.6 72.01 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.781 0.66 . . . . 25.0 112.781 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -109.61 8.04 24.79 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.165 0.507 . . . . 25.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -78.14 126.85 31.41 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 121.248 -0.908 . . . . 25.0 108.731 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 21.12 80.05 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.455 -0.878 . . . . 25.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -118.48 146.79 44.23 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 150.94 46.52 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 106.988 -1.486 . . . . 25.0 106.988 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.95 148.45 46.0 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 174.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -168.25 25.54 Favored Glycine 0 C--N 1.316 -0.578 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.0 mt -105.76 147.17 28.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.218 0.509 . . . . 25.0 110.86 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -129.49 150.8 76.64 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.164 -0.471 . . . . 25.0 109.773 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.9 141.61 37.32 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 117.758 -1.028 . . . . 25.0 114.206 -178.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HA ' ' CE2' ' A' ' 24' ' ' TYR . 26.7 t-20 -92.04 133.32 30.58 Favored Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 104.34 -2.467 . . . . 25.0 104.34 172.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -73.5 -19.0 22.3 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 115.247 1.21 . . . . 25.0 115.247 -175.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -97.94 -35.86 10.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.306 0.574 . . . . 25.0 111.685 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.09 158.89 17.8 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 113.38 0.882 . . . . 25.0 113.38 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -100.68 -42.38 6.54 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 112.489 0.552 . . . . 25.0 112.489 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.0 m -113.27 -25.6 8.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 10.4 m -78.17 151.08 33.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.549 -0.908 . . . . 25.0 108.549 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -141.25 172.84 12.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.424 0.631 . . . . 25.0 111.756 -171.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' A' ' 16' ' ' ASN . 59.9 m-85 -100.38 151.79 21.11 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.18 -2.526 . . . . 25.0 104.18 170.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.0 t -142.7 145.7 33.64 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 108.781 -0.822 . . . . 25.0 108.781 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.3 m -126.43 136.22 52.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.01 -1.478 . . . . 25.0 107.01 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.72 117.96 7.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.693 -1.225 . . . . 25.0 107.693 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.07 34.59 20.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.064 0.946 . . . . 25.0 110.384 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.34 2.95 69.13 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 115.975 -0.557 . . . . 25.0 113.507 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -90.38 144.89 25.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.026 -1.472 . . . . 25.0 107.026 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.38 133.77 34.78 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 123.245 0.34 . . . . 25.0 110.567 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.81 139.89 52.77 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 106.634 -1.617 . . . . 25.0 106.634 169.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -123.6 115.82 22.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.601 -2.74 . . . . 25.0 103.601 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.93 165.72 26.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 25.0 110.817 -169.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 65.7 p -109.34 154.76 22.07 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.466 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -116.13 98.3 51.04 Favored Pre-proline 0 C--N 1.317 -0.83 0 N-CA-C 103.981 -2.6 . . . . 25.0 103.981 171.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.39 -92.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.311 0 N-CA-C 117.666 2.141 . . . . 25.0 117.666 -164.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.45 114.91 11.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.09 -1.631 . . . . 25.0 114.448 -167.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.31 8.75 85.73 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 115.558 0.983 . . . . 25.0 115.558 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.1 mt -122.12 154.71 37.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.146 0.498 . . . . 25.0 112.101 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.4 m -139.0 160.6 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 107.483 -1.303 . . . . 25.0 107.483 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -87.79 142.83 27.51 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.693 -0.803 . . . . 25.0 108.919 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.3 t -126.02 107.31 10.31 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.539 0.685 . . . . 25.0 110.472 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -65.33 -25.09 67.46 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.516 -0.766 . . . . 25.0 112.618 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -65.07 -29.99 70.91 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.498 0.555 . . . . 25.0 112.498 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.92 -2.09 18.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.565 0.166 . . . . 25.0 111.445 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 54.14 37.55 27.32 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.47 -0.567 . . . . 25.0 109.47 -172.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.65 167.9 21.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 25.0 109.971 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.0 t -97.4 140.3 32.07 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.418 -1.697 . . . . 25.0 106.418 175.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 80.6 p -137.89 168.44 19.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.508 0.67 . . . . 25.0 111.781 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.8 m95 . . . . . 0 C--N 1.317 -0.839 0 N-CA-C 106.604 -1.628 . . . . 25.0 106.604 168.753 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.217 -0.61 0 CA-C-O 121.355 0.597 . . . . 25.0 110.795 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -55.69 -37.07 67.86 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.747 0.819 . . . . 25.0 112.748 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.0 t -107.18 -9.76 16.04 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.464 0.65 . . . . 25.0 112.063 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -73.33 128.16 34.7 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.203 -0.936 . . . . 25.0 109.066 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.52 6.2 89.36 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.827 -0.701 . . . . 25.0 112.602 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -94.92 145.71 24.73 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.115 -0.698 . . . . 25.0 109.115 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.91 148.19 44.58 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.937 -2.246 . . . . 25.0 104.937 172.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -66.59 146.19 54.77 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 176.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.59 -177.96 22.8 Favored Glycine 0 C--O 1.238 0.349 0 N-CA-C 110.383 -1.087 . . . . 25.0 110.383 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.9 mt -100.71 139.92 35.71 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.184 0.809 . . . . 25.0 113.184 -177.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -124.97 146.31 53.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 108.103 -1.073 . . . . 25.0 108.103 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.81 150.57 62.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 N-CA-C 114.336 0.86 . . . . 25.0 114.336 -175.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -98.98 132.81 22.91 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.208 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.45 -19.3 10.33 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.373 1.259 . . . . 25.0 115.373 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -88.53 -39.17 14.36 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -118.82 148.85 42.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.555 0.693 . . . . 25.0 112.611 -173.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -58.34 6.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.144 -0.934 . . . . 25.0 113.014 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.1 m -98.06 12.05 35.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 115.718 1.747 . . . . 25.0 115.718 -172.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 9.9 p -103.98 164.95 11.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.329 -0.548 . . . . 25.0 110.152 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -146.07 173.66 11.99 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.793 0.806 . . . . 25.0 109.853 -177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -107.9 140.44 41.02 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 103.333 -2.839 . . . . 25.0 103.333 170.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.9 t -126.24 122.39 35.4 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.817 -1.179 . . . . 25.0 107.817 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.1 m -97.87 127.7 43.99 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.345 -2.094 . . . . 25.0 105.345 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.38 115.04 7.7 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.498 -1.297 . . . . 25.0 107.498 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.96 34.52 22.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.784 0.834 . . . . 25.0 111.479 -176.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.45 13.23 80.11 Favored Glycine 0 C--O 1.239 0.437 0 C-N-CA 120.986 -0.626 . . . . 25.0 114.069 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 mmt-85 -106.71 146.38 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.45 109.99 22.07 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.226 0.329 . . . . 25.0 111.08 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -101.53 135.44 43.04 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.964 -1.495 . . . . 25.0 106.964 173.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -113.87 109.46 18.56 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 105.437 -2.061 . . . . 25.0 105.437 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -141.84 -179.44 6.2 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.884 -0.784 . . . . 25.0 108.884 -169.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 88.4 p -136.94 164.67 27.78 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.949 0.722 . . . . 25.0 112.949 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.32 80.94 37.44 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 175.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -82.53 -74.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.03 0 N-CA-C 117.123 1.932 . . . . 25.0 117.123 -173.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 115.29 16.99 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 114.004 1.112 . . . . 25.0 114.004 -172.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.56 11.62 80.29 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.871 -0.68 . . . . 25.0 114.576 173.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.3 mt -133.36 154.73 50.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.202 0.501 . . . . 25.0 110.469 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.7 m -141.46 157.69 21.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 107.96 -1.126 . . . . 25.0 107.96 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -93.79 126.4 38.95 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.728 -0.607 . . . . 25.0 109.799 177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.1 t -106.75 96.3 6.35 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.584 -0.895 . . . . 25.0 108.584 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -60.94 -27.82 68.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 25.0 111.533 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -31.17 72.27 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.03 0.752 . . . . 25.0 113.03 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 2.3 p -103.21 -8.83 20.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.715 0.293 . . . . 25.0 110.879 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 tptt 64.8 23.07 12.64 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.911 0.885 . . . . 25.0 111.481 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.13 169.17 16.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.113 -0.949 . . . . 25.0 111.409 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.2 t -93.35 139.39 30.72 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.911 -1.885 . . . . 25.0 105.911 173.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.3 p -128.4 161.46 29.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.071 0.463 . . . . 25.0 110.537 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.4 t90 . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 25.0 111.919 -178.903 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.3 p . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.648 0.737 . . . . 25.0 111.037 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -47.76 -52.92 16.88 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.21 -1.93 15.94 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.834 0.679 . . . . 25.0 112.834 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -66.75 138.59 57.49 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 120.783 -1.198 . . . . 25.0 109.067 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.03 4.01 90.39 Favored Glycine 0 C--O 1.247 0.919 0 C-N-CA 121.093 -0.575 . . . . 25.0 113.181 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -113.92 154.94 26.69 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 106.075 -1.824 . . . . 25.0 106.075 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.75 151.7 46.94 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.205 -0.665 . . . . 25.0 109.205 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.49 131.68 48.91 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 158.92 -177.42 35.51 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 110.724 -0.95 . . . . 25.0 110.724 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.6 mt -97.32 147.82 23.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.34 . . . . 25.0 110.571 -178.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -134.21 146.65 60.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 109.082 -0.71 . . . . 25.0 109.082 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -71.35 149.44 56.84 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 117.908 -0.928 . . . . 25.0 114.32 -172.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -95.74 129.63 33.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 106.388 -1.708 . . . . 25.0 106.388 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -80.84 -16.71 10.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 N-CA-C 114.884 1.071 . . . . 25.0 114.884 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -92.53 -39.08 11.57 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.727 0.411 . . . . 25.0 111.219 -176.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -110.54 171.7 7.3 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.717 0.77 . . . . 25.0 109.957 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -109.63 -36.48 5.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.655 -0.702 . . . . 25.0 112.81 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 t -86.9 -26.09 24.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.743 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 55.6 p -89.39 158.77 17.63 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 121.367 -0.833 . . . . 25.0 110.698 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -139.26 169.54 17.58 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.538 0.685 . . . . 25.0 109.3 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -103.56 150.03 24.32 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 102.914 -2.995 . . . . 25.0 102.914 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.8 t -140.13 141.2 36.1 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t -117.05 122.51 44.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.16 120.26 12.87 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.79 34.91 24.36 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.8 0.809 . . . . 25.0 112.01 -177.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.91 3.56 84.49 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.956 -0.566 . . . . 25.0 114.478 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -102.05 138.8 38.53 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.046 -1.094 . . . . 25.0 108.046 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.58 119.22 26.6 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.983 -0.747 . . . . 25.0 108.983 178.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -109.58 143.66 38.97 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.32 -1.733 . . . . 25.0 106.32 172.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -128.66 116.79 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.203 -2.147 . . . . 25.0 105.203 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -145.3 169.07 18.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.252 0.478 . . . . 25.0 110.464 -172.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 60.6 p -107.6 157.81 17.75 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.998 0.519 . . . . 25.0 111.64 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.17 88.3 31.9 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 107.391 -1.337 . . . . 25.0 107.391 173.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.77 -78.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.29 0 N-CA-C 119.486 2.841 . . . . 25.0 119.486 -170.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.08 96.39 1.06 Allowed 'General case' 0 C--O 1.242 0.66 0 N-CA-C 116.534 2.05 . . . . 25.0 116.534 -166.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.81 13.21 83.29 Favored Glycine 0 C--O 1.22 -0.749 0 CA-C-N 114.978 -1.01 . . . . 25.0 112.568 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.6 mt -107.03 137.75 44.5 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.638 0.732 . . . . 25.0 112.697 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.3 m -133.09 147.87 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.417 -0.81 . . . . 25.0 110.241 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -90.88 134.7 34.26 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.132 0.491 . . . . 25.0 110.732 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.7 t -114.02 102.68 10.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.649 1.214 . . . . 25.0 109.705 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.38 -24.18 64.75 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.688 0.996 . . . . 25.0 113.688 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 p -64.93 -35.63 81.77 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 111.689 0.255 . . . . 25.0 111.689 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.3 p -110.91 -2.54 15.99 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 113.706 1.002 . . . . 25.0 113.706 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 61.85 33.38 17.68 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.716 0.807 . . . . 25.0 111.152 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -113.52 166.72 11.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.091 0.472 . . . . 25.0 109.758 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -114.68 129.44 56.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 102.97 -2.974 . . . . 25.0 102.97 165.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.9 p -124.51 157.68 34.73 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.727 -0.471 . . . . 25.0 109.727 -174.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 4.1 t90 . . . . . 0 N--CA 1.445 -0.698 0 N-CA-C 108.596 -0.89 . . . . 25.0 108.596 176.179 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 C--O 1.217 -0.618 0 CA-C-O 120.873 0.368 . . . . 25.0 111.956 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 31' ' ' LEU . 72.3 t80 -57.83 -31.08 66.29 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.082 1.142 . . . . 25.0 114.082 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 m -111.69 2.0 17.0 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.654 0.613 . . . . 25.0 112.654 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -78.95 134.14 36.85 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.878 -1.527 . . . . 25.0 106.878 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.62 4.29 89.14 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.767 -0.73 . . . . 25.0 112.008 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -113.32 148.96 34.65 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 176.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 150.79 43.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.048 -1.834 . . . . 25.0 106.048 173.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.06 150.02 48.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.796 -1.187 . . . . 25.0 107.796 176.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -171.44 24.3 Favored Glycine 0 C--O 1.237 0.294 0 N-CA-C 110.241 -1.143 . . . . 25.0 110.241 -176.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.414 HD22 ' CD2' ' A' ' 23' ' ' PHE . 29.7 mt -105.94 141.0 38.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.558 0.694 . . . . 25.0 112.464 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -124.4 150.3 63.93 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -67.75 147.4 75.35 Favored 'Trans proline' 0 C--N 1.35 0.625 0 N-CA-C 114.325 0.856 . . . . 25.0 114.325 -176.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -92.04 154.96 43.41 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 114.86 -1.064 . . . . 25.0 111.175 -177.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.0 -33.24 19.97 Favored 'Trans proline' 0 CA--C 1.545 1.049 0 N-CA-C 116.71 1.773 . . . . 25.0 116.71 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -162.3 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 113.698 0.999 . . . . 25.0 113.698 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 36.25 -105.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.718 1.377 . . . . 25.0 114.718 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 -61.86 0.12 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.088 0.471 . . . . 25.0 111.545 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.7 p -150.94 37.94 0.65 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.169 0.985 . . . . 25.0 110.243 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 78.0 p -98.8 168.91 9.83 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.478 -1.237 . . . . 25.0 109.662 -179.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.414 ' CD2' HD22 ' A' ' 13' ' ' LEU . 7.9 p90 -145.68 172.73 12.85 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.848 -0.797 . . . . 25.0 108.848 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -102.76 137.17 41.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 102.86 -3.015 . . . . 25.0 102.86 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.1 t -126.72 135.47 51.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.8 m -113.69 127.75 56.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.545 -1.65 . . . . 25.0 106.545 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.48 122.12 12.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.52 31.59 17.39 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 124.07 0.948 . . . . 25.0 110.969 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.37 11.83 79.86 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.864 -0.607 . . . . 25.0 114.231 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -108.9 151.1 26.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.174 -1.047 . . . . 25.0 108.174 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 5' ' ' PHE . 49.5 tp -92.29 129.51 38.21 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.317 0.385 . . . . 25.0 111.907 -178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -122.69 134.11 54.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.342 -2.096 . . . . 25.0 105.342 167.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -113.95 112.69 23.72 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 104.852 -2.277 . . . . 25.0 104.852 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -140.44 173.44 11.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.577 -0.527 . . . . 25.0 109.577 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 84.5 p -122.51 159.51 27.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.737 1.014 . . . . 25.0 113.737 -177.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.89 72.11 62.49 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 107.444 -1.317 . . . . 25.0 107.444 177.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -82.88 -60.67 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.753 0 N-CA-C 117.62 2.123 . . . . 25.0 117.62 -170.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 p -80.63 111.04 16.69 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.938 1.088 . . . . 25.0 113.938 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.33 14.91 76.98 Favored Glycine 0 C--O 1.221 -0.684 0 C-N-CA 120.706 -0.759 . . . . 25.0 113.795 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.7 mt -124.93 149.57 47.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.782 0.791 . . . . 25.0 112.225 -171.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 m -139.16 148.77 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 122.839 0.456 . . . . 25.0 109.87 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -93.41 131.41 38.62 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.979 -0.451 . . . . 25.0 110.003 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.6 t -115.97 109.18 17.21 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.628 -0.879 . . . . 25.0 108.628 176.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -65.69 -28.27 68.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.367 0.506 . . . . 25.0 112.367 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.1 p -70.62 -34.57 72.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.687 0.28 . . . . 25.0 110.494 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.7 t -79.38 -21.85 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.655 -0.498 . . . . 25.0 109.655 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 59.31 29.73 19.33 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.412 -0.959 . . . . 25.0 108.412 -171.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.9 p -144.55 168.46 20.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.114 -0.948 . . . . 25.0 110.126 -174.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.1 t -105.23 134.77 47.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.714 -1.958 . . . . 25.0 105.714 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.8 p -121.03 159.9 24.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.935 0.398 . . . . 25.0 110.056 -176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.8 t90 . . . . . 0 C--N 1.321 -0.632 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 175.081 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 121.329 0.585 . . . . 25.0 111.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.41 ' CD1' HD13 ' A' ' 31' ' ' LEU . 60.0 t80 -57.16 -44.6 83.62 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.855 1.058 . . . . 25.0 113.855 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 m -100.91 1.44 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.905 0.383 . . . . 25.0 111.931 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.47 134.64 39.47 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 107.604 -1.258 . . . . 25.0 107.604 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.17 13.72 81.54 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.988 -0.625 . . . . 25.0 112.482 -177.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -118.62 155.59 30.7 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.915 -1.143 . . . . 25.0 107.915 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.85 155.87 28.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 105.586 -2.005 . . . . 25.0 105.586 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -70.23 148.74 48.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.69 -1.226 . . . . 25.0 107.69 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.81 -173.39 24.05 Favored Glycine 0 C--O 1.238 0.394 0 N-CA-C 110.037 -1.225 . . . . 25.0 110.037 -176.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 23' ' ' PHE . 46.7 mt -96.49 153.7 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.611 0.706 . . . . 25.0 110.551 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -135.46 149.02 68.33 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 107.925 -1.139 . . . . 25.0 107.925 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -67.11 144.31 68.83 Favored 'Trans proline' 0 C--N 1.355 0.904 0 N-CA-C 115.632 1.359 . . . . 25.0 115.632 -173.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 p-10 -83.73 154.22 64.83 Favored Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.83 -24.21 2.3 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 N-CA-C 118.442 2.439 . . . . 25.0 118.442 -172.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -140.48 -36.45 0.48 Allowed 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.641 2.089 . . . . 25.0 116.641 -170.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 19.6 mp0 -76.91 176.71 8.33 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.711 -0.677 . . . . 25.0 111.341 -172.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -69.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.744 1.016 . . . . 25.0 113.744 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -113.61 16.59 18.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.054 1.502 . . . . 25.0 115.054 -172.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.4 p -79.93 172.01 14.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.363 -0.976 . . . . 25.0 108.363 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.408 ' CD2' HD22 ' A' ' 13' ' ' LEU . 8.9 p90 -156.61 170.73 21.72 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.37 0.605 . . . . 25.0 110.332 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -103.66 150.03 24.39 Favored 'General case' 0 CA--C 1.502 -0.866 0 N-CA-C 103.104 -2.924 . . . . 25.0 103.104 170.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.6 t -133.99 133.07 40.87 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.2 m -107.85 127.35 53.64 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.712 -1.958 . . . . 25.0 105.712 174.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.98 121.55 14.18 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.104 -1.443 . . . . 25.0 107.104 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.09 31.88 19.02 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.875 0.87 . . . . 25.0 110.034 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.54 9.55 69.26 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.885 -0.598 . . . . 25.0 114.533 -178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -103.56 150.01 24.35 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.064 -1.087 . . . . 25.0 108.064 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.41 HD13 ' CD1' ' A' ' 5' ' ' PHE . 54.1 tp -91.3 130.01 37.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.39 0.515 . . . . 25.0 112.39 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -122.86 134.74 54.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.74 -1.948 . . . . 25.0 105.74 167.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -113.94 123.31 49.44 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 104.959 -2.237 . . . . 25.0 104.959 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -138.57 161.31 37.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.959 0.409 . . . . 25.0 111.19 -174.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.0 p -110.43 141.22 43.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 177.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -98.99 127.81 33.99 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 102.909 -2.997 . . . . 25.0 102.909 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.74 -106.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 N-CA-C 116.052 1.52 . . . . 25.0 116.052 -166.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.2 t -105.58 152.82 22.6 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.448 -0.783 . . . . 25.0 112.372 -174.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.62 2.4 64.02 Favored Glycine 0 C--O 1.235 0.206 0 N-CA-C 114.767 0.667 . . . . 25.0 114.767 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 51' ' ' TRP . 48.2 mt -131.58 155.28 47.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 25.0 111.279 -174.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.85 157.28 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 107.643 -1.244 . . . . 25.0 107.643 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -82.74 130.29 35.1 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.2 t -115.94 109.79 18.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.512 0.672 . . . . 25.0 109.631 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.49 -25.66 68.09 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.324 0.861 . . . . 25.0 113.324 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.4 p -66.5 -38.11 86.53 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.922 0.712 . . . . 25.0 112.922 -175.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.1 p -104.02 -8.23 19.72 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.391 -0.596 . . . . 25.0 109.391 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.4 tptt 63.29 33.01 14.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.108 -0.951 . . . . 25.0 112.044 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 163.84 20.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.424 -0.807 . . . . 25.0 110.271 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -86.86 125.13 33.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 102.898 -3.001 . . . . 25.0 102.898 165.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.2 p -121.24 161.75 21.41 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.401 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.9 t90 . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.094 -0.957 . . . . 25.0 110.849 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.7 p . . . . . 0 C--O 1.218 -0.576 0 CA-C-O 120.949 0.404 . . . . 25.0 110.789 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.26 -35.84 60.48 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.756 1.762 . . . . 25.0 115.756 -174.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.7 t -105.11 -6.61 19.76 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.121 0.486 . . . . 25.0 111.244 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -71.83 127.45 32.59 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.264 -0.898 . . . . 25.0 109.138 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.55 5.39 88.46 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.977 -0.63 . . . . 25.0 113.28 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -107.68 145.51 33.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 117.475 0.637 . . . . 25.0 110.11 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.15 153.71 41.49 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.145 -1.057 . . . . 25.0 108.145 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -67.21 160.45 26.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.079 -0.51 . . . . 25.0 109.721 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.54 16.5 Favored Glycine 0 C--O 1.235 0.158 0 N-CA-C 110.601 -0.999 . . . . 25.0 110.601 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 mt -96.38 147.27 23.99 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -129.77 151.72 78.61 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 106.201 -1.778 . . . . 25.0 106.201 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.59 144.44 60.52 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 117.799 -1.001 . . . . 25.0 113.815 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -80.99 158.08 70.58 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.875 0.87 . . . . 25.0 112.598 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -86.52 -23.67 1.72 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 N-CA-C 119.093 2.69 . . . . 25.0 119.093 -172.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -136.29 -44.72 0.62 Allowed 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 115.588 1.699 . . . . 25.0 115.588 -170.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -71.24 166.37 21.69 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.69 -1.141 . . . . 25.0 111.326 -173.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.9 tpt85 -77.2 -39.51 48.45 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.696 0.998 . . . . 25.0 113.696 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -128.39 3.73 5.68 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 118.95 2.944 . . . . 25.0 118.95 -167.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.8 p -85.89 178.07 7.41 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.301 -1.5 . . . . 25.0 109.265 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -143.14 170.98 14.71 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.456 0.646 . . . . 25.0 109.792 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -101.42 144.52 30.11 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 101.727 -3.434 . . . . 25.0 101.727 167.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -135.56 136.67 41.31 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 107.659 -1.237 . . . . 25.0 107.659 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.97 129.9 56.03 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.78 117.62 8.75 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.62 33.96 22.25 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.74 0.816 . . . . 25.0 110.815 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.75 5.49 74.52 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.299 -0.477 . . . . 25.0 114.179 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -100.87 144.59 29.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.243 -1.021 . . . . 25.0 108.243 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -91.31 128.67 37.23 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.289 -0.414 . . . . 25.0 111.61 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.27 133.74 55.15 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 169.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -116.21 107.81 15.34 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 104.88 -2.267 . . . . 25.0 104.88 175.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -146.5 172.84 12.95 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 120.469 0.176 . . . . 25.0 110.971 -169.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.5 p -114.17 164.13 14.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 171.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.55 127.64 55.82 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 106.782 -1.562 . . . . 25.0 106.782 178.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.33 -52.05 0.93 Allowed 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 116.489 -1.874 . . . . 25.0 116.335 -172.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.78 131.23 53.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.984 0.735 . . . . 25.0 112.984 -178.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.34 22.75 78.56 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.213 -0.994 . . . . 25.0 115.191 168.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.44 118.98 3.67 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -149.36 157.27 6.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 102.755 -3.054 . . . . 25.0 102.755 160.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -119.92 132.3 55.49 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.8 t -116.34 111.89 20.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.925 -0.768 . . . . 25.0 108.925 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -62.75 -30.42 71.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.596 -0.729 . . . . 25.0 111.991 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.3 p -67.78 -33.09 74.14 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 112.655 0.613 . . . . 25.0 112.655 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.1 -5.61 43.85 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.694 -0.484 . . . . 25.0 109.694 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.95 29.09 17.11 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.582 0.753 . . . . 25.0 109.671 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -141.88 166.57 24.35 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 113.663 0.986 . . . . 25.0 113.663 -167.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.8 t -79.91 138.48 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.685 -1.598 . . . . 25.0 106.685 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.3 p -124.33 167.98 13.61 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.939 -1.504 . . . . 25.0 106.939 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.07 0.462 . . . . 25.0 109.97 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.2 p . . . . . 0 N--CA 1.468 0.451 0 CA-C-O 121.283 0.564 . . . . 25.0 111.904 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -56.94 -43.67 81.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.8 t -108.67 -16.41 14.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.386 0.613 . . . . 25.0 111.316 -178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -67.45 127.72 33.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 O-C-N 120.909 -1.119 . . . . 25.0 110.984 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.76 20.25 74.13 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 120.963 -0.637 . . . . 25.0 112.849 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -118.07 161.89 19.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.49 39.73 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.134 -1.802 . . . . 25.0 106.134 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -66.87 146.08 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.227 -1.397 . . . . 25.0 107.227 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.05 -178.36 25.69 Favored Glycine 0 C--N 1.322 -0.239 0 N-CA-C 110.993 -0.843 . . . . 25.0 110.993 -176.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 23' ' ' PHE . 26.2 mt -96.46 144.78 26.25 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.213 0.53 . . . . 25.0 112.023 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -131.7 154.28 81.76 Favored Pre-proline 0 C--N 1.322 -0.62 0 N-CA-C 108.638 -0.875 . . . . 25.0 108.638 -177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.11 137.59 37.74 Favored 'Trans proline' 0 C--N 1.351 0.663 0 N-CA-C 115.802 1.424 . . . . 25.0 115.802 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -83.51 159.2 61.88 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 125.121 1.368 . . . . 25.0 111.476 -178.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.58 -24.8 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 N-CA-C 118.408 2.426 . . . . 25.0 118.408 -172.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -147.42 -44.41 0.17 Allowed 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.779 2.14 . . . . 25.0 116.779 -171.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -68.72 162.49 26.04 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 113.488 0.921 . . . . 25.0 113.488 -168.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -82.61 -34.54 27.59 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.233 0.827 . . . . 25.0 113.233 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.1 t -107.91 -21.71 12.73 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.426 1.639 . . . . 25.0 115.426 -170.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 80.5 p -82.56 164.03 21.11 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.342 -0.848 . . . . 25.0 112.706 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.426 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.2 p90 -142.38 174.27 10.77 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -104.64 146.45 28.91 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 102.75 -3.056 . . . . 25.0 102.75 168.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.3 t -132.46 134.46 45.1 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.23 -1.396 . . . . 25.0 107.23 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.1 t -110.96 119.93 40.71 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 102.071 -3.307 . . . . 25.0 102.071 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.77 121.67 11.31 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.295 -0.631 . . . . 25.0 109.295 -175.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.36 31.23 18.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.057 0.943 . . . . 25.0 110.99 -176.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.55 8.43 84.06 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.149 -0.548 . . . . 25.0 113.689 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.72 151.43 30.26 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.642 -0.503 . . . . 25.0 109.642 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.29 132.27 34.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.976 -0.556 . . . . 25.0 111.343 -177.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -128.67 139.1 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.264 -1.754 . . . . 25.0 106.264 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -121.23 111.38 17.31 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.296 -2.113 . . . . 25.0 105.296 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.62 176.4 8.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.792 -0.818 . . . . 25.0 108.792 -171.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 75.5 p -124.28 156.38 37.02 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 115.477 1.658 . . . . 25.0 115.477 -174.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -112.27 98.0 41.5 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.191 -1.411 . . . . 25.0 107.191 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.44 -91.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.302 0 N-CA-C 117.146 1.941 . . . . 25.0 117.146 -172.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -77.34 115.79 17.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 115.197 1.555 . . . . 25.0 115.197 -171.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 2.68 55.53 Favored Glycine 0 C--O 1.227 -0.312 0 N-CA-C 115.332 0.893 . . . . 25.0 115.332 172.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -105.1 134.66 47.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.108 0.454 . . . . 25.0 110.064 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -126.5 146.1 32.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -81.9 132.64 35.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -118.89 109.33 15.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.014 0.912 . . . . 25.0 108.634 176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.99 -26.7 68.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.46 -0.791 . . . . 25.0 112.88 -176.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p -67.8 -29.76 69.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.542 0.571 . . . . 25.0 112.542 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 32.0 p -103.68 -5.3 22.72 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 121.425 -0.11 . . . . 25.0 111.225 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 54.66 39.44 31.26 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.6 p -146.88 168.77 20.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.57 -0.741 . . . . 25.0 110.299 -172.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 137.98 38.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.227 -1.768 . . . . 25.0 106.227 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -124.46 149.96 46.24 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.742 0.306 . . . . 25.0 110.201 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.8 t90 . . . . . 0 C--N 1.324 -0.53 0 N-CA-C 107.846 -1.168 . . . . 25.0 107.846 174.996 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.215 -0.725 0 CA-C-O 121.324 0.583 . . . . 25.0 110.502 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -55.69 -29.4 59.34 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.997 1.11 . . . . 25.0 113.997 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.2 t -112.31 -10.56 13.79 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.204 0.526 . . . . 25.0 112.396 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -72.68 126.68 30.47 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.327 -0.858 . . . . 25.0 109.376 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.04 2.1 84.04 Favored Glycine 0 C--O 1.225 -0.451 0 C-N-CA 121.302 -0.475 . . . . 25.0 113.004 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -101.03 147.56 26.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 O-C-N 122.264 -0.551 . . . . 25.0 111.839 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.13 161.47 26.87 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.872 -1.159 . . . . 25.0 107.872 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -72.32 179.8 3.25 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.228 0.537 . . . . 25.0 110.803 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.28 -176.63 24.55 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 112.046 -0.422 . . . . 25.0 112.046 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.76 145.76 25.52 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.006 0.432 . . . . 25.0 111.834 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.67 147.2 57.56 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 108.997 -0.742 . . . . 25.0 108.997 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.76 155.62 65.44 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 114.661 0.985 . . . . 25.0 114.661 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -95.24 153.81 39.61 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.129 0.972 . . . . 25.0 110.903 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.05 -26.57 10.7 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 117.149 -1.434 . . . . 25.0 115.711 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -163.76 -78.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.232 0.469 . . . . 25.0 111.258 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 38.62 -129.22 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.142 0.977 . . . . 25.0 112.297 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -136.43 -55.93 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.486 0.714 . . . . 25.0 110.152 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 m -156.56 47.4 0.45 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.161 0.43 . . . . 25.0 112.161 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -133.13 169.7 16.48 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 115.904 -0.589 . . . . 25.0 111.469 -174.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -153.64 174.34 14.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.978 -1.489 . . . . 25.0 106.978 -175.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -105.42 160.83 14.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.57 141.51 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.521 -0.918 . . . . 25.0 108.521 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.6 127.24 55.08 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 128.33 14.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.062 -1.459 . . . . 25.0 107.062 178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.34 30.67 10.58 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.095 0.776 . . . . 25.0 113.095 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.91 9.14 79.31 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.427 -0.416 . . . . 25.0 113.922 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -110.4 147.4 34.09 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.479 -0.934 . . . . 25.0 108.479 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -89.82 130.27 36.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.308 -0.86 . . . . 25.0 110.381 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -120.75 149.54 42.38 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.029 -2.582 . . . . 25.0 104.029 168.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -118.64 137.8 53.03 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 103.051 -2.944 . . . . 25.0 103.051 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -133.61 168.45 18.66 Favored 'General case' 0 CA--C 1.503 -0.863 0 O-C-N 123.293 0.37 . . . . 25.0 110.968 -173.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.0 p -136.9 159.1 42.86 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 102.145 -3.279 . . . . 25.0 102.145 170.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.1 m -123.17 78.54 52.26 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 104.091 -2.559 . . . . 25.0 104.091 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 -47.46 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 116.871 -1.619 . . . . 25.0 115.825 -167.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -100.95 116.21 32.26 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.055 1.131 . . . . 25.0 114.055 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.54 -11.44 6.99 Favored Glycine 0 N--CA 1.463 0.452 0 N-CA-C 118.791 2.277 . . . . 25.0 118.791 170.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.7 mt -120.79 152.66 38.08 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.44 1.12 . . . . 25.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.8 m -136.63 144.33 32.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.634 -0.876 . . . . 25.0 108.634 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.415 ' HA ' ' HA ' ' A' ' 49' ' ' CYS . 19.2 t80 -74.68 127.15 32.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.0 0.429 . . . . 25.0 110.927 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -112.88 111.49 22.29 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 122.033 0.92 . . . . 25.0 108.801 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -63.78 -21.97 66.68 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.781 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.2 p -67.95 -34.92 77.51 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.491 0.552 . . . . 25.0 112.491 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 3.1 p -104.28 -9.78 18.32 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 121.109 -0.236 . . . . 25.0 111.441 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 63.11 33.98 14.07 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.899 0.88 . . . . 25.0 110.591 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -142.83 166.68 23.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.642 -0.708 . . . . 25.0 109.26 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 42' ' ' PHE . 30.7 m -86.8 146.83 26.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 106.735 -1.579 . . . . 25.0 106.735 169.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.17 160.7 27.27 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.2 t90 . . . . . 0 C--N 1.321 -0.65 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.354 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.533 0.298 0 N-CA-C 113.33 0.863 . . . . 25.0 113.33 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -62.01 -41.47 98.1 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.747 -0.596 . . . . 25.0 112.465 -177.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.4 -12.0 9.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.576 0.703 . . . . 25.0 111.027 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.65 128.66 37.25 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 121.445 -0.785 . . . . 25.0 110.236 -177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.97 16.41 80.7 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 121.058 -0.592 . . . . 25.0 112.851 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -114.15 148.42 37.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 117.007 0.403 . . . . 25.0 110.647 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.15 150.81 47.11 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.472 -0.936 . . . . 25.0 108.472 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -68.77 164.66 21.31 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.357 0.598 . . . . 25.0 110.677 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.92 -175.13 16.0 Favored Glycine 0 CA--C 1.516 0.113 0 N-CA-C 110.306 -1.118 . . . . 25.0 110.306 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.1 mt -93.59 152.06 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.699 1.0 . . . . 25.0 113.699 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -133.68 148.79 69.95 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.98 145.5 35.82 Favored 'Trans proline' 0 C--N 1.349 0.555 0 N-CA-C 114.281 0.839 . . . . 25.0 114.281 -174.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -102.56 120.34 53.3 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 110.123 -0.325 . . . . 25.0 110.123 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.04 -18.1 14.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 116.31 -1.993 . . . . 25.0 113.808 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -70.34 -52.21 24.37 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 111.977 0.362 . . . . 25.0 111.977 -175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.81 141.07 52.17 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.26 -18.75 44.89 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.338 1.066 . . . . 25.0 108.326 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -77.71 -0.87 28.51 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.292 -1.777 . . . . 25.0 113.323 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 60.7 p -137.65 170.09 16.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.578 0.704 . . . . 25.0 112.172 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -143.52 172.56 12.62 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 25.0 108.741 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -107.79 152.8 23.88 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 102.959 -2.978 . . . . 25.0 102.959 171.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.7 t -140.02 142.75 36.22 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.49 128.91 56.47 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.682 -2.34 . . . . 25.0 104.682 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.55 113.72 6.94 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 107.234 -1.395 . . . . 25.0 107.234 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.35 34.86 24.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.786 0.834 . . . . 25.0 110.189 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.65 -1.49 57.7 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.691 0.636 . . . . 25.0 114.691 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -88.82 150.14 23.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.341 -0.985 . . . . 25.0 108.341 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.85 124.63 37.98 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 123.597 0.56 . . . . 25.0 109.821 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -118.99 136.5 54.07 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.275 -1.38 . . . . 25.0 107.275 172.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -117.28 118.36 32.05 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -142.06 157.92 44.35 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.158 0.435 . . . . 25.0 110.838 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 48.8 p -94.1 162.44 13.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.554 . . . . 25.0 109.886 177.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 44.9 t -114.62 122.63 33.59 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 107.258 -1.386 . . . . 25.0 107.258 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.62 -41.49 0.25 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 115.977 -2.215 . . . . 25.0 117.584 -173.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.1 m -103.66 117.32 34.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 115.653 1.723 . . . . 25.0 115.653 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.17 21.39 79.25 Favored Glycine 0 C--O 1.21 -1.404 0 C-N-CA 120.499 -0.857 . . . . 25.0 113.322 171.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -46.55 104.73 0.05 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 119.851 3.278 . . . . 25.0 119.851 -162.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -149.06 162.69 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 104.507 -2.405 . . . . 25.0 104.507 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -112.22 131.06 55.7 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.774 -0.579 . . . . 25.0 110.802 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 t -107.07 113.72 27.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.474 -0.565 . . . . 25.0 109.474 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.71 -35.32 79.36 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.657 0.614 . . . . 25.0 112.657 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.0 p -69.1 -33.14 73.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 120.769 0.319 . . . . 25.0 111.067 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 46.1 t -81.86 -22.13 37.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.672 -0.492 . . . . 25.0 109.672 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.2 tptt 59.97 26.86 16.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.684 -1.228 . . . . 25.0 107.684 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.0 p -142.03 167.86 21.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.273 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.47 138.06 35.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.0 p -131.39 168.01 18.32 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.905 -0.776 . . . . 25.0 108.905 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.6 m0 . . . . . 0 C--N 1.324 -0.525 0 N-CA-C 109.26 -0.645 . . . . 25.0 109.26 176.365 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 C--O 1.222 -0.349 0 CA-C-O 121.593 0.711 . . . . 25.0 111.824 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.401 ' CD1' HD22 ' A' ' 31' ' ' LEU . 81.8 t80 -63.01 -41.16 99.49 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.8 t -95.99 -17.26 21.13 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.602 0.715 . . . . 25.0 111.007 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -68.16 132.39 47.1 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.069 -1.019 . . . . 25.0 109.071 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.44 12.81 79.83 Favored Glycine 0 C--O 1.226 -0.389 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.303 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -122.27 163.23 20.02 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.235 -1.395 . . . . 25.0 107.235 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.4 32.88 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 106.313 -1.736 . . . . 25.0 106.313 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.44 148.12 49.99 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.127 -1.064 . . . . 25.0 108.127 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.12 -177.28 23.66 Favored Glycine 0 C--O 1.237 0.315 0 N-CA-C 111.23 -0.748 . . . . 25.0 111.23 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.6 mt -96.46 139.75 32.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.146 0.498 . . . . 25.0 110.777 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -125.11 152.85 71.27 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 107.997 -1.112 . . . . 25.0 107.997 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.42 147.42 71.3 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 118.004 -0.864 . . . . 25.0 113.791 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -86.49 159.46 52.86 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 115.145 -0.934 . . . . 25.0 111.585 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -83.86 -20.19 4.6 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 118.032 2.282 . . . . 25.0 118.032 -172.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -146.01 -47.06 0.2 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.171 2.285 . . . . 25.0 117.171 -169.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -72.24 169.99 15.03 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.243 -0.435 . . . . 25.0 111.056 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -81.97 -50.49 9.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.192 1.182 . . . . 25.0 114.192 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 m -112.57 18.59 18.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 116.13 1.9 . . . . 25.0 116.13 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 86.9 p -102.07 165.46 11.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.173 0.442 . . . . 25.0 110.407 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -142.16 174.5 10.55 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.725 -0.843 . . . . 25.0 108.725 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -105.42 136.21 45.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 103.266 -2.865 . . . . 25.0 103.266 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -121.45 120.24 34.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.799 -1.185 . . . . 25.0 107.799 177.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.9 t -103.74 121.39 42.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 105.146 -2.168 . . . . 25.0 105.146 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -148.33 118.59 7.31 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.886 -0.413 . . . . 25.0 109.886 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.38 35.92 24.19 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.714 0.806 . . . . 25.0 112.335 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.01 3.38 84.58 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.071 -0.585 . . . . 25.0 113.639 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -104.74 150.8 24.45 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.053 -1.091 . . . . 25.0 108.053 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.401 HD22 ' CD1' ' A' ' 5' ' ' PHE . 62.7 tp -107.81 132.81 53.01 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.006 -0.739 . . . . 25.0 109.006 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -123.18 134.99 54.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 104.934 -2.247 . . . . 25.0 104.934 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -113.88 108.12 16.63 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 104.932 -2.247 . . . . 25.0 104.932 174.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -135.68 177.06 8.12 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 79.8 p -126.08 168.6 13.76 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -176.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 81.2 m -100.19 98.23 7.37 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 105.739 -1.948 . . . . 25.0 105.739 171.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -84.98 -96.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 0 N-CA-C 116.002 1.501 . . . . 25.0 116.002 -172.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -73.78 114.89 12.57 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.187 -0.945 . . . . 25.0 113.402 -172.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.18 11.54 75.32 Favored Glycine 0 C--O 1.229 -0.209 0 CA-C-N 115.681 -0.691 . . . . 25.0 114.048 174.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 39.5 mt -124.95 153.73 42.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.48 0.64 . . . . 25.0 112.057 -173.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.0 m -139.23 161.66 28.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.021 -1.103 . . . . 25.0 108.021 177.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -93.21 132.75 37.09 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -111.24 101.91 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.249 0.547 . . . . 25.0 109.628 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.47 -19.09 64.44 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.704 1.001 . . . . 25.0 113.704 -175.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 p -71.65 -52.09 19.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.969 -0.457 . . . . 25.0 111.302 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.09 -1.99 32.65 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.034 0.753 . . . . 25.0 113.034 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.0 mptt 64.94 35.13 8.5 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.443 1.097 . . . . 25.0 108.457 177.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.6 m -105.58 157.21 17.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.233 -0.894 . . . . 25.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.1 t -103.26 121.64 43.13 Favored 'General case' 0 C--N 1.321 -0.652 1 N-CA-C 99.807 -4.146 . . . . 25.0 99.807 162.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -141.12 167.82 21.27 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -169.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 121.24 0.543 . . . . 25.0 111.916 -178.643 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 115.905 1.817 . . . . 25.0 115.905 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -60.33 -39.4 86.91 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.482 -0.761 . . . . 25.0 112.971 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.07 -0.57 15.61 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 112.515 0.561 . . . . 25.0 112.515 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.36 127.33 32.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 108.889 -0.782 . . . . 25.0 108.889 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.22 13.84 82.87 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 121.137 -0.554 . . . . 25.0 112.508 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -104.9 147.12 28.11 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.4 154.16 38.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 106.844 -1.539 . . . . 25.0 106.844 177.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.19 149.4 49.59 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.529 -0.915 . . . . 25.0 108.529 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.72 -175.1 20.46 Favored Glycine 0 C--O 1.234 0.105 0 N-CA-C 111.329 -0.708 . . . . 25.0 111.329 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.405 HD22 ' CD2' ' A' ' 23' ' ' PHE . 42.9 mt -97.93 147.49 24.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 25.0 112.286 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -128.49 147.64 64.83 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 107.729 -1.211 . . . . 25.0 107.729 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -73.57 150.77 46.21 Favored 'Trans proline' 0 C--N 1.346 0.421 0 N-CA-C 114.453 0.905 . . . . 25.0 114.453 -175.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -94.35 121.45 63.53 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.108 -1.071 . . . . 25.0 108.108 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.71 -18.82 21.89 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 116.262 -2.025 . . . . 25.0 113.718 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -88.66 -36.62 16.13 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 111.917 0.34 . . . . 25.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -116.09 149.45 38.94 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 114.328 1.233 . . . . 25.0 114.328 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -79.63 -58.07 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.88 -1.054 . . . . 25.0 112.037 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.8 m -98.0 21.56 10.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 116.124 1.898 . . . . 25.0 116.124 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 54.4 p -134.43 159.47 40.97 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.158 -0.682 . . . . 25.0 109.158 175.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.405 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.1 p90 -138.15 176.27 8.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.487 -0.778 . . . . 25.0 110.767 -172.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -107.85 144.93 34.37 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 104.116 -2.55 . . . . 25.0 104.116 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -130.13 140.2 50.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -120.69 133.05 55.38 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.507 -1.294 . . . . 25.0 107.507 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 109.48 4.47 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.3 36.39 26.96 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.645 0.736 . . . . 25.0 110.635 -177.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.29 -5.5 59.65 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 114.788 0.675 . . . . 25.0 114.788 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 mmt85 -84.15 148.93 26.51 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.251 -1.389 . . . . 25.0 107.251 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 131.46 52.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.963 -0.384 . . . . 25.0 109.963 -177.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -123.54 139.42 54.03 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 107.958 -1.126 . . . . 25.0 107.958 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -119.82 111.71 18.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.375 -1.713 . . . . 25.0 106.375 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -140.27 168.19 20.39 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.902 -0.407 . . . . 25.0 109.902 -173.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 62.1 p -112.2 159.5 18.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.088 0.774 . . . . 25.0 113.088 -176.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.86 90.12 50.2 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 105.434 -2.062 . . . . 25.0 105.434 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -79.79 -89.17 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 N-CA-C 117.053 1.905 . . . . 25.0 117.053 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -77.23 115.13 16.76 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.695 1.369 . . . . 25.0 114.695 -169.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 1.01 50.04 Favored Glycine 0 CA--C 1.519 0.304 0 N-CA-C 115.23 0.852 . . . . 25.0 115.23 174.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -103.71 134.31 47.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.795 0.331 . . . . 25.0 110.482 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.3 m -131.6 147.17 32.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.138 0.494 . . . . 25.0 110.12 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -80.61 135.83 36.13 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.629 -0.508 . . . . 25.0 109.629 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.6 t -109.45 101.54 10.49 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 107.866 -1.161 . . . . 25.0 107.866 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.37 -27.82 67.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.531 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 p -70.03 -41.26 74.48 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.224 0.453 . . . . 25.0 112.224 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.6 p -96.74 -10.47 26.75 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 -175.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mptt 66.4 31.11 8.45 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.183 0.993 . . . . 25.0 109.232 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.16 163.04 27.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.635 -0.711 . . . . 25.0 109.441 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.7 t -106.87 138.69 42.56 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 104.162 -2.533 . . . . 25.0 104.162 173.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -141.0 164.36 30.48 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.749 -0.463 . . . . 25.0 109.749 -174.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.2 t90 . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 107.667 -1.234 . . . . 25.0 107.667 175.711 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.8 p . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 121.286 0.565 . . . . 25.0 112.219 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -59.4 -33.49 71.28 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 t -105.62 -11.38 16.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.287 0.565 . . . . 25.0 111.403 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -71.95 132.2 44.0 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.35 14.89 77.8 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.906 -0.664 . . . . 25.0 111.904 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -110.24 143.59 40.17 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.156 -0.683 . . . . 25.0 109.156 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.1 152.62 36.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 104.351 -2.463 . . . . 25.0 104.351 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -68.01 149.47 49.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.055 -0.72 . . . . 25.0 109.055 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.48 -176.11 21.61 Favored Glycine 0 N--CA 1.459 0.216 0 N-CA-C 110.88 -0.888 . . . . 25.0 110.88 -177.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.3 mt -94.71 145.51 24.8 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.88 0.84 . . . . 25.0 110.32 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -127.92 150.32 73.18 Favored Pre-proline 0 C--O 1.238 0.482 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.245 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.49 148.97 74.13 Favored 'Trans proline' 0 C--N 1.352 0.724 0 N-CA-C 114.127 0.78 . . . . 25.0 114.127 -178.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB3' ' HA ' ' A' ' 23' ' ' PHE . 12.6 p-10 -102.71 150.54 37.8 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 114.869 -1.06 . . . . 25.0 111.448 -173.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.01 -30.0 7.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 N-CA-C 116.578 1.722 . . . . 25.0 116.578 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -78.34 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.931 0.787 . . . . 25.0 112.243 -176.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 34.43 -120.12 0.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.828 1.251 . . . . 25.0 113.262 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.6 tpt180 -155.82 -56.99 0.09 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.789 0.662 . . . . 25.0 112.789 177.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.1 m -153.68 39.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 p -137.93 157.27 46.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 -174.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.456 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 0.1 OUTLIER -149.42 175.9 11.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.398 -0.819 . . . . 25.0 108.88 -167.126 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -98.56 154.32 18.0 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.615 -0.883 . . . . 25.0 108.615 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -139.81 131.85 27.9 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -110.28 134.33 52.36 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 106.144 -1.798 . . . . 25.0 106.144 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.09 126.89 11.79 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.36 31.35 14.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.545 0.738 . . . . 25.0 111.895 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.16 69.75 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 115.434 0.934 . . . . 25.0 115.434 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -112.26 149.96 31.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 118.218 1.009 . . . . 25.0 108.483 177.18 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.95 133.65 33.92 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.226 0.824 . . . . 25.0 113.226 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.47 ' CE1' ' HD2' ' A' ' 30' ' ' ARG . 63.7 m-85 -117.33 146.64 43.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.463 -2.421 . . . . 25.0 104.463 165.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -117.23 131.58 56.82 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.562 -2.755 . . . . 25.0 103.562 169.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -136.88 169.41 17.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.6 0.593 . . . . 25.0 112.6 -168.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -136.31 157.79 45.96 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 101.082 -3.674 . . . . 25.0 101.082 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.8 m -106.45 108.3 61.57 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 103.9 -2.63 . . . . 25.0 103.9 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.35 -51.38 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.482 -1.878 . . . . 25.0 116.917 -164.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -105.75 114.47 28.65 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 115.663 1.727 . . . . 25.0 115.663 -172.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.69 4.04 37.55 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 117.66 1.824 . . . . 25.0 117.66 167.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -118.65 146.69 44.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.462 0.631 . . . . 25.0 111.117 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.07 151.04 33.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.069 -1.086 . . . . 25.0 108.069 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -80.32 118.89 22.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.343 0.592 . . . . 25.0 111.101 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.1 t -95.97 105.85 17.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.818 -1.179 . . . . 25.0 107.818 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -62.35 -28.88 70.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.528 0.566 . . . . 25.0 112.528 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -71.73 -33.48 68.75 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.936 -0.306 . . . . 25.0 111.148 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 51.9 t -84.6 -23.13 29.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 25.0 111.99 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 60.23 30.35 19.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 108.399 -0.963 . . . . 25.0 108.399 -170.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 10.4 p -143.3 165.04 28.58 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.241 -0.89 . . . . 25.0 108.851 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.45 136.47 33.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.706 -1.59 . . . . 25.0 106.706 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 34.0 p -121.16 158.9 26.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.201 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 . . . . . 0 C--N 1.324 -0.506 0 N-CA-C 107.861 -1.163 . . . . 25.0 107.861 178.381 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 122.024 0.916 . . . . 25.0 111.704 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.41 -40.69 71.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.513 -1.221 . . . . 25.0 111.684 173.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.4 t -114.02 -3.82 13.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.521 0.563 . . . . 25.0 112.521 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -63.29 117.68 6.95 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 120.534 -1.354 . . . . 25.0 109.473 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.95 17.39 78.5 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 116.556 -0.293 . . . . 25.0 113.669 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -91.89 145.41 24.57 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.37 148.51 51.53 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 106.862 -1.533 . . . . 25.0 106.862 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -68.24 144.25 54.97 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.63 -177.1 21.48 Favored Glycine 0 C--O 1.242 0.633 0 N-CA-C 109.765 -1.334 . . . . 25.0 109.765 -176.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 23' ' ' PHE . 27.9 mt -96.66 151.8 19.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.264 1.03 . . . . 25.0 112.092 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -132.01 153.45 81.37 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 114.869 -1.059 . . . . 25.0 110.21 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.6 143.44 38.07 Favored 'Trans proline' 0 C--N 1.354 0.851 0 N-CA-C 116.11 1.542 . . . . 25.0 116.11 -174.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -88.73 158.61 47.69 Favored Pre-proline 0 CA--C 1.555 1.167 0 CA-C-N 114.877 -1.056 . . . . 25.0 111.539 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.62 -18.71 3.02 Favored 'Trans proline' 0 C--N 1.353 0.813 0 N-CA-C 118.927 2.626 . . . . 25.0 118.927 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -133.95 -59.77 0.83 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 117.124 2.268 . . . . 25.0 117.124 -172.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -70.38 161.46 30.43 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 114.463 1.283 . . . . 25.0 114.463 -167.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -64.81 -41.97 95.38 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 115.654 1.724 . . . . 25.0 115.654 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.9 m -129.34 3.35 5.14 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.118 1.895 . . . . 25.0 116.118 -173.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.4 p -77.71 165.29 24.41 Favored 'General case' 0 C--O 1.212 -0.874 0 O-C-N 121.208 -0.933 . . . . 25.0 110.122 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.461 ' CD2' HD22 ' A' ' 13' ' ' LEU . 16.5 p90 -148.89 168.69 22.34 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.214 1.007 . . . . 25.0 111.107 177.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -100.98 153.92 19.12 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.882 -2.636 . . . . 25.0 103.882 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.9 t -140.63 149.07 41.83 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 106.785 -1.561 . . . . 25.0 106.785 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m -123.79 129.38 50.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 105.612 -1.995 . . . . 25.0 105.612 176.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.2 119.54 14.74 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.283 -1.006 . . . . 25.0 108.283 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.39 35.38 17.22 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 123.45 0.7 . . . . 25.0 111.965 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.88 14.38 78.47 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.578 0.591 . . . . 25.0 114.578 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -109.48 143.96 38.39 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.57 137.7 37.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.765 0.793 . . . . 25.0 112.684 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -128.95 136.16 49.99 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 106.355 -1.72 . . . . 25.0 106.355 166.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -125.09 113.0 17.16 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 103.891 -2.633 . . . . 25.0 103.891 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -137.14 162.58 33.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.082 0.467 . . . . 25.0 111.418 -170.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -108.36 149.85 28.13 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.162 -0.681 . . . . 25.0 109.162 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.04 120.98 47.17 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 103.322 -2.844 . . . . 25.0 103.322 175.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.45 -84.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 N-CA-C 118.19 2.342 . . . . 25.0 118.19 -165.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.3 m -97.53 114.96 26.95 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.896 1.813 . . . . 25.0 115.896 -169.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.74 26.37 69.6 Favored Glycine 0 C--O 1.221 -0.673 0 N-CA-C 116.436 1.335 . . . . 25.0 116.436 170.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.64 161.97 17.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.083 0.942 . . . . 25.0 111.311 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -138.83 171.35 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 106.583 -1.636 . . . . 25.0 106.583 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -101.69 137.5 39.92 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.921 0.782 . . . . 25.0 110.007 177.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.9 t -116.82 108.17 15.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 122.129 0.966 . . . . 25.0 111.076 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -65.41 -24.28 67.16 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 113.112 0.782 . . . . 25.0 113.112 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -66.61 -40.32 88.76 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.137 -0.352 . . . . 25.0 111.07 -176.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 p -103.89 -7.83 20.16 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.595 -0.442 . . . . 25.0 111.8 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm 62.56 35.45 14.45 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.659 0.783 . . . . 25.0 110.266 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.54 160.75 28.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.49 0.662 . . . . 25.0 110.635 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 43.8 t -86.27 128.2 34.88 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.122 -3.288 . . . . 25.0 102.122 168.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.7 p -126.92 163.97 22.48 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 122.581 0.352 . . . . 25.0 111.363 -172.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t90 . . . . . 0 C--N 1.327 -0.413 0 CA-C-O 120.895 0.379 . . . . 25.0 111.636 -179.419 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 121.797 0.808 . . . . 25.0 109.806 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.71 -36.71 70.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.083 -0.962 . . . . 25.0 111.912 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.72 -0.99 21.42 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.853 0.686 . . . . 25.0 112.853 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -74.53 128.64 36.06 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 121.612 -0.68 . . . . 25.0 109.302 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 76.59 22.18 73.17 Favored Glycine 0 C--O 1.227 -0.288 0 C-N-CA 120.964 -0.636 . . . . 25.0 112.881 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -113.44 148.15 36.46 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.892 -0.781 . . . . 25.0 108.892 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.72 31.02 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.39 142.83 56.6 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.877 -0.786 . . . . 25.0 108.877 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.75 -174.22 22.76 Favored Glycine 0 C--O 1.229 -0.156 0 C-N-CA 121.21 -0.519 . . . . 25.0 113.122 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -96.67 148.83 22.47 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.593 0.357 . . . . 25.0 110.332 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -131.08 148.19 69.28 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-N 116.028 -0.533 . . . . 25.0 111.381 -176.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.12 147.45 60.6 Favored 'Trans proline' 0 C--N 1.351 0.708 0 N-CA-C 113.656 0.599 . . . . 25.0 113.656 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -121.89 150.81 56.77 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 114.965 -1.016 . . . . 25.0 111.259 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -86.12 -18.85 3.34 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 N-CA-C 117.712 2.158 . . . . 25.0 117.712 -174.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -117.16 -58.62 2.04 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 116.453 2.02 . . . . 25.0 116.453 -168.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.4 mp0 -68.3 150.17 48.55 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.202 0.525 . . . . 25.0 111.865 -173.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.16 -65.39 1.02 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-O 121.505 0.669 . . . . 25.0 111.555 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -95.32 24.56 4.96 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.565 0.95 . . . . 25.0 113.565 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.06 162.04 37.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.6 -177.85 6.63 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.298 -1.001 . . . . 25.0 108.298 -163.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -101.82 156.84 17.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.59 -1.633 . . . . 25.0 106.59 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.0 t -143.75 145.6 32.51 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 107.826 -1.176 . . . . 25.0 107.826 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 t -131.73 130.88 42.51 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.25 -1.019 . . . . 25.0 108.25 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.13 123.22 12.11 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.178 -1.045 . . . . 25.0 108.178 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.48 34.39 18.21 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.61 0.764 . . . . 25.0 112.444 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.59 13.35 82.03 Favored Glycine 0 C--O 1.237 0.342 0 C-N-CA 121.217 -0.516 . . . . 25.0 113.862 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -108.26 140.12 41.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.767 -1.198 . . . . 25.0 107.767 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 41.5 tp -87.77 128.65 35.32 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.315 0.384 . . . . 25.0 110.262 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -122.02 140.78 52.08 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 104.421 -2.437 . . . . 25.0 104.421 169.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -114.0 122.15 46.04 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 102.989 -2.967 . . . . 25.0 102.989 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -136.42 164.56 27.87 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 113.739 1.014 . . . . 25.0 113.739 -166.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.3 p -123.37 160.83 25.94 Favored 'General case' 0 C--N 1.32 -0.7 1 N-CA-C 100.191 -4.003 . . . . 25.0 100.191 164.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -101.55 123.5 44.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 106.021 -1.844 . . . . 25.0 106.021 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.43 -55.43 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 115.435 -2.576 . . . . 25.0 116.492 -170.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.58 85.0 6.6 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 115.389 1.625 . . . . 25.0 115.389 -174.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.53 -9.51 0.85 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 118.284 2.073 . . . . 25.0 118.284 168.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 31.6 mt -81.07 155.92 26.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 118.163 0.981 . . . . 25.0 113.11 -166.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.4 m -124.14 151.82 29.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 107.449 -1.315 . . . . 25.0 107.449 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -75.25 126.64 31.44 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.404 -0.81 . . . . 25.0 109.334 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.4 t -109.94 109.49 20.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.403 -0.962 . . . . 25.0 108.403 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.83 -14.01 60.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.723 1.008 . . . . 25.0 113.723 -176.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.5 p -71.48 -47.86 52.89 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.299 -0.876 . . . . 25.0 110.249 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.2 p -92.78 -6.66 48.48 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.772 1.027 . . . . 25.0 113.772 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 59.94 35.16 21.65 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.108 -1.441 . . . . 25.0 107.108 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -142.91 168.03 20.67 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.584 -0.734 . . . . 25.0 110.389 -172.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.73 131.27 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.101 -1.074 . . . . 25.0 108.101 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.86 152.96 43.32 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.699 0.285 . . . . 25.0 110.369 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.0 t90 . . . . . 0 C--N 1.323 -0.583 0 N-CA-C 107.35 -1.352 . . . . 25.0 107.35 174.36 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 C--O 1.222 -0.355 0 CA-C-O 121.881 0.848 . . . . 25.0 109.985 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -56.27 -31.34 63.51 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.302 -0.863 . . . . 25.0 111.384 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.6 t -110.98 -16.28 13.56 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.475 0.917 . . . . 25.0 113.475 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.81 126.14 28.09 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 119.297 -0.961 . . . . 25.0 108.498 177.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 10.88 72.34 Favored Glycine 0 CA--C 1.521 0.454 0 CA-C-N 115.544 -0.753 . . . . 25.0 113.544 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -106.91 149.39 27.51 Favored 'General case' 0 CA--C 1.504 -0.813 0 O-C-N 121.448 -1.03 . . . . 25.0 108.392 178.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.48 151.43 41.05 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 105.83 -1.915 . . . . 25.0 105.83 176.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.78 150.36 49.23 Favored 'General case' 0 C--O 1.246 0.904 0 N-CA-C 107.578 -1.268 . . . . 25.0 107.578 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.0 179.59 19.13 Favored Glycine 0 C--O 1.242 0.612 0 N-CA-C 110.097 -1.201 . . . . 25.0 110.097 -175.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.2 mt -101.33 149.44 24.03 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 112.865 0.691 . . . . 25.0 112.865 -177.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -132.79 144.12 51.57 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 107.622 -1.251 . . . . 25.0 107.622 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.16 149.19 45.59 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 117.32 -1.32 . . . . 25.0 114.249 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -96.3 118.27 65.58 Favored Pre-proline 0 C--O 1.216 -0.702 0 N-CA-C 108.586 -0.894 . . . . 25.0 108.586 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -79.92 -13.18 13.04 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 115.415 1.275 . . . . 25.0 115.415 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -87.41 -42.73 12.62 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.151 0.501 . . . . 25.0 111.167 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -97.94 155.32 17.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.16 -0.927 . . . . 25.0 112.689 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -69.2 -46.85 66.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.521 1.674 . . . . 25.0 115.521 -177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -130.44 20.75 5.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.742 1.756 . . . . 25.0 115.742 -167.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 63.1 p -111.01 164.15 13.11 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -135.13 166.58 22.75 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 122.128 0.966 . . . . 25.0 108.591 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -97.6 145.78 25.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 101.209 -3.626 . . . . 25.0 101.209 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -135.76 138.44 42.66 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.4 m -114.13 123.95 50.88 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.825 -0.805 . . . . 25.0 108.825 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.98 113.62 13.62 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.81 38.54 26.88 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.913 0.758 . . . . 25.0 109.383 -177.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.36 15.2 74.85 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 115.565 0.986 . . . . 25.0 115.565 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -113.57 149.18 34.85 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -93.3 130.44 39.03 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 113.674 0.99 . . . . 25.0 113.674 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.97 137.83 53.23 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 169.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -117.65 108.98 16.09 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 105.332 -2.099 . . . . 25.0 105.332 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.73 165.4 27.39 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.188 -0.32 . . . . 25.0 110.786 -168.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 46.2 p -102.82 164.11 11.82 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.849 0.833 . . . . 25.0 111.623 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.18 95.8 38.2 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 104.5 -2.407 . . . . 25.0 104.5 167.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -91.83 -119.13 0.01 OUTLIER 'Trans proline' 0 C--O 1.25 1.12 0 C-N-CA 120.435 0.757 . . . . 25.0 113.211 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.49 142.61 58.36 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 121.115 -0.99 . . . . 25.0 112.185 -178.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 79.27 -7.6 51.67 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 116.947 1.539 . . . . 25.0 116.947 173.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.6 mt -131.83 142.69 49.79 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.146 0.973 . . . . 25.0 111.773 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.8 149.71 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -90.1 132.39 35.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.657 0.742 . . . . 25.0 112.631 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.8 t -113.32 102.64 10.54 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 121.726 0.774 . . . . 25.0 109.737 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -63.74 -27.75 69.41 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 114.385 1.254 . . . . 25.0 114.385 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 p -67.7 -35.67 79.23 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.053 0.39 . . . . 25.0 112.053 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.3 p -104.83 -7.82 19.16 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.079 0.4 . . . . 25.0 112.079 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm 59.43 44.76 14.57 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.087 1.355 . . . . 25.0 113.069 -174.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.02 168.08 16.56 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.02 -0.991 . . . . 25.0 110.998 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.23 132.3 53.22 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 103.119 -2.919 . . . . 25.0 103.119 168.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 77.1 p -118.69 158.5 25.39 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.76 0.791 . . . . 25.0 111.314 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 115.098 -0.955 . . . . 25.0 109.354 178.654 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.6 p . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 114.136 1.161 . . . . 25.0 114.136 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -64.53 -45.42 87.23 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 113.959 1.096 . . . . 25.0 113.959 -173.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.34 -7.31 13.98 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.563 0.697 . . . . 25.0 111.979 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -70.85 122.51 20.05 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 116.154 -0.476 . . . . 25.0 109.83 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.32 19.95 68.01 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.173 -0.537 . . . . 25.0 113.041 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -119.48 149.86 41.19 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 117.171 0.486 . . . . 25.0 111.097 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 153.27 42.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.245 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 26' ' ' CYS . 72.6 m-20 -70.45 148.41 48.35 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.652 -0.704 . . . . 25.0 110.353 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.23 -179.41 23.26 Favored Glycine 0 CA--C 1.517 0.169 0 N-CA-C 109.942 -1.263 . . . . 25.0 109.942 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -98.75 143.93 28.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.286 1.043 . . . . 25.0 111.108 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.98 148.2 61.95 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.665 -0.495 . . . . 25.0 109.665 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.35 148.86 55.84 Favored 'Trans proline' 0 C--N 1.35 0.614 0 N-CA-C 115.249 1.211 . . . . 25.0 115.249 -175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -84.07 154.77 64.05 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-N 114.408 -1.269 . . . . 25.0 110.38 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -81.48 -21.15 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 N-CA-C 115.981 1.493 . . . . 25.0 115.981 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 -29.67 0.49 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.3 1.593 . . . . 25.0 115.3 -169.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -74.47 -178.51 3.56 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 124.482 1.113 . . . . 25.0 112.349 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -134.96 -56.05 0.82 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.498 -0.751 . . . . 25.0 111.549 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -79.87 -2.84 45.36 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.5 p -130.36 154.58 47.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.437 . . . . 25.0 110.529 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -177.93 6.07 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.279 -1.008 . . . . 25.0 108.279 -170.112 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -106.04 158.87 16.49 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 176.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.1 t -142.73 153.41 43.3 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.091 -1.448 . . . . 25.0 107.091 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.514 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -126.46 128.29 46.73 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 104.46 -2.422 . . . . 25.0 104.46 175.184 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.85 118.76 11.81 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.97 -1.493 . . . . 25.0 106.97 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.71 33.72 21.91 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.801 0.84 . . . . 25.0 110.352 -173.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.15 7.94 68.46 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 114.619 0.608 . . . . 25.0 114.619 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -101.46 153.26 19.86 Favored 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 121.863 -0.786 . . . . 25.0 108.98 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.98 128.8 33.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.144 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.33 149.52 52.34 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.264 -2.495 . . . . 25.0 104.264 169.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -113.97 146.18 40.49 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 103.125 -2.917 . . . . 25.0 103.125 171.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -129.16 164.7 22.81 Favored 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 109.144 -0.687 . . . . 25.0 109.144 -171.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.0 p -146.58 155.03 42.18 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 102.022 -3.325 . . . . 25.0 102.022 171.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -116.76 117.55 37.52 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 103.086 -2.931 . . . . 25.0 103.086 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.86 -87.6 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 117.528 -1.181 . . . . 25.0 114.676 -171.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.4 t -104.07 153.11 21.27 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.565 -0.709 . . . . 25.0 110.874 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -10.48 4.71 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 118.968 2.347 . . . . 25.0 118.968 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 51' ' ' TRP . 73.5 mt -129.31 144.77 51.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 118.09 0.945 . . . . 25.0 109.439 -176.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.9 m -135.47 147.19 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 109.508 -0.553 . . . . 25.0 109.508 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -77.55 130.34 36.81 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.392 -0.818 . . . . 25.0 109.662 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -126.49 122.73 36.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.49 0.662 . . . . 25.0 109.638 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -64.31 -21.72 66.7 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.4 p -67.67 -32.25 72.78 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.784 0.265 . . . . 25.0 111.467 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.9 t -94.11 -21.75 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.438 -0.578 . . . . 25.0 109.438 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.3 tptt 60.32 26.85 16.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.982 -1.008 . . . . 25.0 108.46 -171.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -143.26 171.69 13.76 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.286 -1.324 . . . . 25.0 107.663 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.3 t -88.25 127.06 35.45 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.433 -1.691 . . . . 25.0 106.433 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 41.8 p -112.67 161.52 16.76 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.409 -0.589 . . . . 25.0 109.409 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.406 ' HA ' HD23 ' A' ' 40' ' ' LEU . 21.6 t90 . . . . . 0 C--N 1.323 -0.583 0 N-CA-C 109.34 -0.615 . . . . 25.0 109.34 177.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.9 p . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 121.263 0.554 . . . . 25.0 111.447 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -58.35 -39.48 79.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.092 0.775 . . . . 25.0 113.092 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.06 2.34 16.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.916 0.71 . . . . 25.0 112.916 -177.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -69.66 123.9 22.58 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.452 -0.573 . . . . 25.0 109.452 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.65 17.93 78.35 Favored Glycine 0 C--O 1.226 -0.37 0 C-N-CA 121.216 -0.516 . . . . 25.0 113.706 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -102.23 145.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-N 117.66 0.73 . . . . 25.0 109.995 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 152.35 44.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.857 -1.065 . . . . 25.0 108.868 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.66 160.39 22.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.667 -0.697 . . . . 25.0 111.899 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.11 -176.55 16.21 Favored Glycine 0 N--CA 1.458 0.143 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.966 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -96.33 151.88 19.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.48 0.657 . . . . 25.0 111.539 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -132.64 147.31 65.04 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 106.094 -1.817 . . . . 25.0 106.094 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.61 146.38 49.09 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 117.368 -1.288 . . . . 25.0 113.528 -175.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -107.59 124.19 35.75 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 116.43 -0.35 . . . . 25.0 110.147 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.71 -15.96 8.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 116.234 1.59 . . . . 25.0 116.234 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -123.24 -47.03 2.03 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 119.554 3.168 . . . . 25.0 119.554 -170.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.36 -65.76 0.51 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 116.273 1.953 . . . . 25.0 116.273 -164.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -172.47 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.985 -0.746 . . . . 25.0 108.985 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.3 p -118.36 14.98 13.88 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.286 -1.746 . . . . 25.0 106.286 175.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 114.251 -1.34 . . . . 25.0 110.374 -178.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -133.32 -179.46 5.52 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.978 -1.119 . . . . 25.0 107.978 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -107.86 145.17 34.05 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.621 -3.103 . . . . 25.0 102.621 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -134.33 143.14 47.51 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 106.609 -1.626 . . . . 25.0 106.609 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.91 127.7 52.1 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 177.498 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.17 120.59 14.98 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.72 32.25 17.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.645 0.778 . . . . 25.0 111.855 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.2 79.77 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 121.119 -0.562 . . . . 25.0 113.669 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -118.62 148.36 42.79 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.678 -1.23 . . . . 25.0 107.678 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 51.4 tp -91.41 129.17 37.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.53 0.566 . . . . 25.0 112.53 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -120.72 132.56 55.14 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.429 -1.693 . . . . 25.0 106.429 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -113.98 107.34 15.54 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 104.309 -2.478 . . . . 25.0 104.309 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -143.51 169.62 17.36 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.788 -0.449 . . . . 25.0 109.788 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.6 p -117.42 160.07 21.77 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.274 -0.639 . . . . 25.0 109.274 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.53 127.68 55.7 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 107.371 -1.344 . . . . 25.0 107.371 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.83 -55.68 0.25 Allowed 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 116.091 -2.139 . . . . 25.0 117.028 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -106.31 143.75 33.99 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.709 -0.619 . . . . 25.0 112.275 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.08 14.39 70.93 Favored Glycine 0 C--O 1.222 -0.597 0 N-CA-C 115.909 1.124 . . . . 25.0 115.909 169.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.3 111.6 0.6 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 118.945 2.943 . . . . 25.0 118.945 -160.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.3 m -145.62 161.49 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 N-CA-C 104.569 -2.382 . . . . 25.0 104.569 165.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -116.05 130.03 56.63 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.678 -0.49 . . . . 25.0 109.678 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.2 t -110.17 114.22 27.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.843 0.83 . . . . 25.0 109.812 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -63.01 -31.35 72.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.386 -0.824 . . . . 25.0 113.118 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 44.4 p -65.57 -32.07 73.46 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 28.3 p -104.51 -5.38 21.62 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.39 -0.226 . . . . 25.0 110.39 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? 52.3 41.25 30.37 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 -173.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.4 p -143.15 168.37 19.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.613 -0.722 . . . . 25.0 111.417 -172.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.3 t -86.21 139.93 30.61 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.061 -1.459 . . . . 25.0 107.061 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.9 p -128.02 167.84 16.14 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 105.497 -2.038 . . . . 25.0 105.497 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 N-CA-C 106.243 -1.762 . . . . 25.0 106.243 174.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 121.228 0.537 . . . . 25.0 112.055 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.558 ' CD1' HD13 ' A' ' 31' ' ' LEU . 77.1 t80 -64.91 -28.85 69.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.353 -0.385 . . . . 25.0 111.913 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -111.31 10.11 21.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.625 -0.262 . . . . 25.0 111.529 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -73.69 138.8 44.93 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 71.65 17.58 76.65 Favored Glycine 0 C--O 1.227 -0.31 0 C-N-CA 121.027 -0.606 . . . . 25.0 112.733 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -126.33 147.72 49.68 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.125 -0.695 . . . . 25.0 109.125 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.17 156.56 35.76 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -69.94 148.07 49.41 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.744 -1.206 . . . . 25.0 107.744 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.04 -174.39 24.41 Favored Glycine 0 N--CA 1.454 -0.124 0 N-CA-C 110.243 -1.143 . . . . 25.0 110.243 -175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.2 mt -97.64 148.85 22.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.427 0.614 . . . . 25.0 111.347 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -132.13 154.51 81.69 Favored Pre-proline 0 C--O 1.24 0.568 0 N-CA-C 112.111 0.412 . . . . 25.0 112.111 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.413 ' HB3' HD21 ' A' ' 44' ' ' ASN . 59.4 Cg_endo -65.07 131.1 27.55 Favored 'Trans proline' 0 C--N 1.357 0.984 0 N-CA-C 114.346 0.864 . . . . 25.0 114.346 -177.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -118.8 150.69 48.92 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.562 -172.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.65 -19.44 4.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 N-CA-C 117.3 2.0 . . . . 25.0 117.3 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -79.49 -59.85 2.59 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 116.235 1.939 . . . . 25.0 116.235 -166.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.91 151.24 40.8 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.252 0.464 . . . . 25.0 112.252 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -60.45 -33.2 72.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.766 0.826 . . . . 25.0 111.142 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 p -85.69 -0.34 54.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.769 -1.105 . . . . 25.0 113.684 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 91.2 p -122.46 167.54 13.21 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 -178.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -154.83 173.89 15.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.409 0.623 . . . . 25.0 111.764 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -102.83 145.29 29.99 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 102.343 -3.206 . . . . 25.0 102.343 169.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.2 t -135.72 141.62 44.92 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.2 m -117.11 127.54 54.24 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 105.732 -1.951 . . . . 25.0 105.732 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.68 128.52 23.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.835 -1.913 . . . . 25.0 105.835 177.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.29 28.54 13.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.986 0.914 . . . . 25.0 110.578 -173.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 69.17 23.37 76.23 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 121.202 -0.523 . . . . 25.0 113.799 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.1 mmt-85 -123.82 149.37 45.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 117.855 0.827 . . . . 25.0 109.013 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.558 HD13 ' CD1' ' A' ' 5' ' ' PHE . 51.2 tp -79.42 127.9 32.68 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 114.046 1.128 . . . . 25.0 114.046 -177.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -123.86 131.96 53.67 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 167.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -113.98 124.31 51.85 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.202 -1.777 . . . . 25.0 106.202 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -143.49 170.94 14.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.024 -0.361 . . . . 25.0 110.024 -172.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 69.8 p -121.31 162.79 19.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 176.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.5 t -123.14 71.53 44.4 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 106.474 -1.676 . . . . 25.0 106.474 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.27 -27.71 9.36 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 116.201 -2.066 . . . . 25.0 117.277 -164.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.07 86.41 5.53 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.505 1.298 . . . . 25.0 114.505 -175.021 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.98 2.14 29.31 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.312 2.085 . . . . 25.0 118.312 168.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.0 mt -122.69 162.87 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.215 1.007 . . . . 25.0 111.158 -173.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.31 159.82 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.457 -0.338 . . . . 25.0 110.66 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.78 125.89 29.15 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.258 -0.577 . . . . 25.0 110.351 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -107.2 109.72 21.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.862 0.839 . . . . 25.0 109.226 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.413 HD21 ' HB3' ' A' ' 15' ' ' PRO . 0.7 OUTLIER -66.29 -20.55 66.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.11 1.152 . . . . 25.0 114.11 -176.101 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.6 p -70.75 -43.65 68.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.545 0.572 . . . . 25.0 112.545 -177.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 13.9 p -104.5 -6.96 20.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.93 0.344 . . . . 25.0 111.93 -177.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 61.66 39.32 14.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.857 0.863 . . . . 25.0 110.928 -176.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.96 169.14 13.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.577 -0.738 . . . . 25.0 109.505 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.5 t -99.16 122.89 42.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -146.24 173.67 12.02 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.062 0.145 . . . . 25.0 110.676 -173.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 . . . . . 0 N--CA 1.468 0.439 0 CA-C-O 120.94 0.4 . . . . 25.0 111.569 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 114.234 1.198 . . . . 25.0 114.234 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.27 -37.32 86.82 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 125.02 1.328 . . . . 25.0 114.008 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -104.34 -1.98 26.16 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 118.437 0.562 . . . . 25.0 111.429 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -74.73 127.17 32.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.645 1.212 . . . . 25.0 108.661 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.9 -8.35 70.26 Favored Glycine 0 CA--C 1.546 2.006 0 CA-C-N 113.959 -1.473 . . . . 25.0 113.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -88.44 146.51 25.18 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 122.107 -0.643 . . . . 25.0 110.842 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.97 154.73 35.63 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.074 -1.084 . . . . 25.0 108.074 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -63.5 148.11 49.56 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 109.906 -0.405 . . . . 25.0 109.906 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.36 -169.64 25.37 Favored Glycine 0 C--O 1.211 -1.3 0 N-CA-C 110.485 -1.046 . . . . 25.0 110.485 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.5 mt -115.37 138.19 51.25 Favored 'General case' 0 CA--C 1.488 -1.44 0 O-C-N 120.502 -1.587 . . . . 25.0 110.835 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -124.99 146.45 53.55 Favored Pre-proline 0 C--O 1.218 -0.567 0 C-N-CA 125.198 1.399 . . . . 25.0 108.317 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 151.21 40.96 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 115.998 -2.201 . . . . 25.0 113.901 -171.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -87.37 138.07 32.28 Favored Pre-proline 0 CA--C 1.556 1.21 0 N-CA-C 109.1 -0.704 . . . . 25.0 109.1 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -79.41 -19.79 10.04 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 N-CA-C 116.107 1.541 . . . . 25.0 116.107 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -102.14 -42.38 6.08 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.941 -0.474 . . . . 25.0 111.816 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -106.44 162.16 13.95 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.9 -0.778 . . . . 25.0 108.9 173.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.52 -8.05 10.53 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 116.484 2.031 . . . . 25.0 116.484 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.23 10.36 31.83 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 107.849 -1.167 . . . . 25.0 107.849 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 79.7 p -121.75 167.31 13.12 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 107.867 -1.16 . . . . 25.0 107.867 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -146.72 169.95 17.98 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.099 -0.955 . . . . 25.0 109.657 -175.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.23 133.86 42.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 104.302 -2.481 . . . . 25.0 104.302 164.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -112.71 135.69 53.16 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.21 -2.145 . . . . 25.0 105.21 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -116.09 125.04 51.85 Favored 'General case' 0 C--O 1.246 0.873 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 174.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.7 124.86 16.37 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 124.243 0.965 . . . . 25.0 108.988 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 51.63 37.1 19.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.021 0.915 . . . . 25.0 111.186 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.37 7.73 64.58 Favored Glycine 0 CA--C 1.543 1.823 0 CA-C-N 115.12 -0.946 . . . . 25.0 115.156 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -108.56 150.67 27.16 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 120.805 -1.409 . . . . 25.0 108.325 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.89 133.88 36.84 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -124.76 149.23 47.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 105.715 -1.957 . . . . 25.0 105.715 171.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -129.13 105.95 8.52 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.803 -1.185 . . . . 25.0 108.09 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.97 175.23 9.73 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 112.743 0.645 . . . . 25.0 112.743 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 72.7 p -113.08 163.31 14.88 Favored 'General case' 0 C--O 1.206 -1.191 0 O-C-N 123.682 0.614 . . . . 25.0 111.708 177.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.2 88.69 37.96 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 102.136 -3.283 . . . . 25.0 102.136 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -85.09 -66.27 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.139 0 N-CA-C 120.638 3.284 . . . . 25.0 120.638 -167.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.54 117.81 25.55 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.045 -1.659 . . . . 25.0 112.703 -170.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.24 17.91 79.66 Favored Glycine 0 CA--C 1.55 2.273 0 CA-C-O 117.658 -1.634 . . . . 25.0 113.271 174.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 71.1 mt -138.13 153.19 49.26 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 114.785 1.402 . . . . 25.0 114.785 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.82 166.96 18.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -101.4 129.7 47.47 Favored 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.762 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.6 t -119.92 112.01 18.66 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 123.222 1.487 . . . . 25.0 109.895 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.02 -23.88 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.935 -1.029 . . . . 25.0 112.455 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.2 p -68.52 -29.89 68.58 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 118.964 -0.541 . . . . 25.0 111.583 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.37 -6.72 22.71 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.5 tptt 59.29 33.65 22.63 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 123.124 1.44 . . . . 25.0 108.963 -177.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 2.6 p -145.89 167.49 23.14 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 113.647 -1.615 . . . . 25.0 113.935 -170.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.1 t -85.79 136.31 33.37 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 115.15 -0.932 . . . . 25.0 109.377 175.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.9 p -131.39 170.64 14.38 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.355 -0.98 . . . . 25.0 108.355 -175.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 . . . . . 0 C--O 1.207 -1.157 0 C-N-CA 124.129 0.972 . . . . 25.0 112.423 179.697 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.415 0 CA-C-O 119.036 -0.869 . . . . 25.0 111.408 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.6 p -76.49 154.43 83.82 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 118.368 1.084 . . . . 25.0 108.428 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.99 134.65 25.84 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 117.216 -1.39 . . . . 25.0 112.956 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 p -105.06 10.51 33.98 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.632 0.604 . . . . 25.0 112.632 -174.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -54.5 -37.61 65.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.054 1.501 . . . . 25.0 115.054 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.44 3.88 15.1 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.939 0.4 . . . . 25.0 112.05 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.56 122.09 19.88 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.631 -0.668 . . . . 25.0 109.812 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.64 -1.45 82.84 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 121.078 -0.582 . . . . 25.0 113.643 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -82.52 143.9 30.77 Favored 'General case' 0 CA--C 1.508 -0.664 0 O-C-N 122.275 -0.544 . . . . 25.0 111.61 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.76 158.47 32.32 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 171.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -67.23 175.3 2.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.881 -0.599 . . . . 25.0 111.404 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.15 -178.86 19.32 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 110.73 -0.948 . . . . 25.0 110.73 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.424 HD22 ' CD2' ' A' ' 23' ' ' PHE . 45.9 mt -100.88 149.28 24.03 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.135 0.493 . . . . 25.0 112.192 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -130.07 151.68 78.76 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.378 0.671 . . . . 25.0 109.676 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.31 146.47 63.12 Favored 'Trans proline' 0 C--N 1.352 0.752 0 N-CA-C 115.11 1.158 . . . . 25.0 115.11 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -90.77 155.87 45.18 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 114.655 -1.157 . . . . 25.0 110.71 -176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -89.87 -17.94 1.58 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 N-CA-C 117.743 2.17 . . . . 25.0 117.743 -173.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -137.0 -50.42 0.65 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 117.3 2.333 . . . . 25.0 117.3 -168.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -74.41 164.08 27.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -171.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -65.76 -44.34 86.16 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 115.357 1.614 . . . . 25.0 115.357 -176.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 m -143.43 35.29 1.32 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.046 1.499 . . . . 25.0 115.046 -174.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 89.7 p -98.05 171.31 8.33 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 34' ' ' GLN . 14.5 p90 -147.48 172.66 13.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.471 0.653 . . . . 25.0 109.719 178.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -105.95 148.42 27.67 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 103.761 -2.681 . . . . 25.0 103.761 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -134.16 139.99 46.25 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.874 -1.899 . . . . 25.0 105.874 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -116.15 129.57 56.38 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.48 -0.933 . . . . 25.0 108.48 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.97 114.54 9.82 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.813 -1.18 . . . . 25.0 107.813 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.25 38.52 27.86 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.212 0.605 . . . . 25.0 112.168 -178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.63 1.91 73.41 Favored Glycine 0 N--CA 1.465 0.593 0 N-CA-C 115.316 0.886 . . . . 25.0 115.316 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -98.52 148.02 24.18 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.1 tp -100.98 132.81 46.22 Favored 'General case' 0 C--O 1.218 -0.576 0 O-C-N 123.799 0.687 . . . . 25.0 111.539 -176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -119.67 142.73 48.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.688 -1.597 . . . . 25.0 106.688 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -122.45 115.76 22.79 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.056 -2.201 . . . . 25.0 105.056 174.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.437 ' HB2' ' CE2' ' A' ' 23' ' ' PHE . 78.2 mt-30 -139.79 171.04 14.79 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.646 -0.502 . . . . 25.0 109.646 -171.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 59.9 p -110.66 155.72 22.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.41 0.893 . . . . 25.0 113.41 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.19 89.94 22.38 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 105.292 -2.114 . . . . 25.0 105.292 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.49 -52.33 0.05 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 0 N-CA-C 118.846 2.595 . . . . 25.0 118.846 -166.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 m -104.24 106.68 17.26 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.32 1.6 . . . . 25.0 115.32 -170.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.88 -4.89 14.34 Favored Glycine 0 N--CA 1.467 0.703 0 N-CA-C 114.318 0.487 . . . . 25.0 114.318 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.26 136.47 34.52 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.226 0.61 . . . . 25.0 110.868 -175.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.7 m -131.5 149.6 33.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 108.528 -0.916 . . . . 25.0 108.528 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -80.49 138.64 36.58 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.652 -0.499 . . . . 25.0 109.652 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -119.37 113.44 20.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.976 0.893 . . . . 25.0 110.086 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.8 -19.91 65.38 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.154 0.798 . . . . 25.0 113.154 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.2 p -75.18 -36.02 61.5 Favored 'General case' 0 C--O 1.219 -0.533 0 O-C-N 122.005 -0.435 . . . . 25.0 111.722 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.1 p -102.07 -7.78 21.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.635 0.976 . . . . 25.0 113.635 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 mptt 57.82 36.9 26.84 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 106.995 -1.483 . . . . 25.0 106.995 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.3 p -140.9 166.49 24.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 25.0 108.872 -174.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.1 t -113.98 137.27 51.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.333 -2.099 . . . . 25.0 105.333 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.1 t -141.0 160.23 40.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.136 0.493 . . . . 25.0 109.737 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -74.1 139.29 44.48 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.949 -1.13 . . . . 25.0 107.949 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -75.07 124.59 27.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.953 0.406 . . . . 25.0 110.417 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -103.46 -1.02 47.03 Favored Glycine 0 C--O 1.224 -0.512 0 CA-C-N 116.147 -0.479 . . . . 25.0 114.248 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.0 tt -101.67 118.61 37.3 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.026 -0.691 . . . . 25.0 111.18 -177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 73.8 t -109.83 114.2 56.72 Favored Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 108.084 -1.08 . . . . 25.0 108.084 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -91.56 21.58 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.694 1.596 . . . . 25.0 112.794 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 . . . . . 0 CA--C 1.509 -0.619 0 CA-C-O 117.265 -1.35 . . . . 25.0 109.61 -177.661 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.704 0 CA-C-O 119.598 -0.557 . . . . 25.0 111.877 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.6 p -153.79 162.89 25.59 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.59 146.43 67.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 116.698 -1.735 . . . . 25.0 113.898 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -29.49 68.68 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 116.372 1.989 . . . . 25.0 116.372 -174.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.85 -33.6 72.01 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.781 0.66 . . . . 25.0 112.781 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -109.61 8.04 24.79 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.165 0.507 . . . . 25.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -78.14 126.85 31.41 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 121.248 -0.908 . . . . 25.0 108.731 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 21.12 80.05 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.455 -0.878 . . . . 25.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -118.48 146.79 44.23 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 150.94 46.52 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 106.988 -1.486 . . . . 25.0 106.988 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.95 148.45 46.0 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 174.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -168.25 25.54 Favored Glycine 0 C--N 1.316 -0.578 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.0 mt -105.76 147.17 28.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.218 0.509 . . . . 25.0 110.86 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -129.49 150.8 76.64 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.164 -0.471 . . . . 25.0 109.773 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.9 141.61 37.32 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 117.758 -1.028 . . . . 25.0 114.206 -178.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HA ' ' CE2' ' A' ' 24' ' ' TYR . 26.7 t-20 -92.04 133.32 30.58 Favored Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 104.34 -2.467 . . . . 25.0 104.34 172.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -73.5 -19.0 22.3 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 115.247 1.21 . . . . 25.0 115.247 -175.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -97.94 -35.86 10.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.306 0.574 . . . . 25.0 111.685 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.09 158.89 17.8 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 113.38 0.882 . . . . 25.0 113.38 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -100.68 -42.38 6.54 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 112.489 0.552 . . . . 25.0 112.489 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.0 m -113.27 -25.6 8.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 10.4 m -78.17 151.08 33.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.549 -0.908 . . . . 25.0 108.549 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -141.25 172.84 12.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.424 0.631 . . . . 25.0 111.756 -171.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' A' ' 16' ' ' ASN . 59.9 m-85 -100.38 151.79 21.11 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.18 -2.526 . . . . 25.0 104.18 170.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.0 t -142.7 145.7 33.64 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 108.781 -0.822 . . . . 25.0 108.781 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.3 m -126.43 136.22 52.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.01 -1.478 . . . . 25.0 107.01 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.72 117.96 7.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.693 -1.225 . . . . 25.0 107.693 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.07 34.59 20.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.064 0.946 . . . . 25.0 110.384 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.34 2.95 69.13 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 115.975 -0.557 . . . . 25.0 113.507 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -90.38 144.89 25.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.026 -1.472 . . . . 25.0 107.026 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.38 133.77 34.78 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 123.245 0.34 . . . . 25.0 110.567 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.81 139.89 52.77 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 106.634 -1.617 . . . . 25.0 106.634 169.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -123.6 115.82 22.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.601 -2.74 . . . . 25.0 103.601 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.93 165.72 26.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 25.0 110.817 -169.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 65.7 p -109.34 154.76 22.07 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.466 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -116.13 98.3 51.04 Favored Pre-proline 0 C--N 1.317 -0.83 0 N-CA-C 103.981 -2.6 . . . . 25.0 103.981 171.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.39 -92.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.311 0 N-CA-C 117.666 2.141 . . . . 25.0 117.666 -164.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.45 114.91 11.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.09 -1.631 . . . . 25.0 114.448 -167.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.31 8.75 85.73 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 115.558 0.983 . . . . 25.0 115.558 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.1 mt -122.12 154.71 37.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.146 0.498 . . . . 25.0 112.101 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.4 m -139.0 160.6 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 107.483 -1.303 . . . . 25.0 107.483 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -87.79 142.83 27.51 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.693 -0.803 . . . . 25.0 108.919 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.3 t -126.02 107.31 10.31 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.539 0.685 . . . . 25.0 110.472 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -65.33 -25.09 67.46 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.516 -0.766 . . . . 25.0 112.618 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -65.07 -29.99 70.91 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.498 0.555 . . . . 25.0 112.498 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.92 -2.09 18.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.565 0.166 . . . . 25.0 111.445 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 54.14 37.55 27.32 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.47 -0.567 . . . . 25.0 109.47 -172.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.65 167.9 21.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 25.0 109.971 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.0 t -97.4 140.3 32.07 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.418 -1.697 . . . . 25.0 106.418 175.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 80.6 p -137.89 168.44 19.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.508 0.67 . . . . 25.0 111.781 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -67.43 163.85 20.0 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.604 -1.628 . . . . 25.0 106.604 168.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -55.53 129.47 39.04 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.852 -0.795 . . . . 25.0 108.852 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.09 48.49 2.76 Favored Glycine 0 N--CA 1.464 0.509 0 N-CA-C 119.175 2.43 . . . . 25.0 119.175 -167.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 tt -74.11 124.57 26.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.4 t -78.08 117.05 63.63 Favored Pre-proline 0 CA--C 1.548 0.874 0 N-CA-C 109.18 -0.674 . . . . 25.0 109.18 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -91.74 9.64 2.79 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 N-CA-C 115.623 1.355 . . . . 25.0 115.623 -174.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.5 ptt85 . . . . . 0 C--O 1.249 1.033 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 -174.643 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 CA-C-O 118.595 -1.114 . . . . 25.0 111.269 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 t -67.68 142.5 96.01 Favored Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 107.214 -1.402 . . . . 25.0 107.214 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.97 154.95 53.2 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 116.448 -1.901 . . . . 25.0 112.844 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.4 p -70.42 -12.17 61.4 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 121.355 0.597 . . . . 25.0 110.795 177.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -55.69 -37.07 67.86 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.747 0.819 . . . . 25.0 112.748 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.0 t -107.18 -9.76 16.04 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.464 0.65 . . . . 25.0 112.063 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -73.33 128.16 34.7 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.203 -0.936 . . . . 25.0 109.066 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.52 6.2 89.36 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.827 -0.701 . . . . 25.0 112.602 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -94.92 145.71 24.73 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.115 -0.698 . . . . 25.0 109.115 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.91 148.19 44.58 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.937 -2.246 . . . . 25.0 104.937 172.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -66.59 146.19 54.77 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 176.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.59 -177.96 22.8 Favored Glycine 0 C--O 1.238 0.349 0 N-CA-C 110.383 -1.087 . . . . 25.0 110.383 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.9 mt -100.71 139.92 35.71 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.184 0.809 . . . . 25.0 113.184 -177.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -124.97 146.31 53.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 108.103 -1.073 . . . . 25.0 108.103 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.81 150.57 62.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 N-CA-C 114.336 0.86 . . . . 25.0 114.336 -175.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -98.98 132.81 22.91 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.208 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.45 -19.3 10.33 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.373 1.259 . . . . 25.0 115.373 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -88.53 -39.17 14.36 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -118.82 148.85 42.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.555 0.693 . . . . 25.0 112.611 -173.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -58.34 6.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.144 -0.934 . . . . 25.0 113.014 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.1 m -98.06 12.05 35.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 115.718 1.747 . . . . 25.0 115.718 -172.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 9.9 p -103.98 164.95 11.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.329 -0.548 . . . . 25.0 110.152 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -146.07 173.66 11.99 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.793 0.806 . . . . 25.0 109.853 -177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -107.9 140.44 41.02 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 103.333 -2.839 . . . . 25.0 103.333 170.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.9 t -126.24 122.39 35.4 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.817 -1.179 . . . . 25.0 107.817 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.1 m -97.87 127.7 43.99 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.345 -2.094 . . . . 25.0 105.345 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.38 115.04 7.7 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.498 -1.297 . . . . 25.0 107.498 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.96 34.52 22.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.784 0.834 . . . . 25.0 111.479 -176.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.45 13.23 80.11 Favored Glycine 0 C--O 1.239 0.437 0 C-N-CA 120.986 -0.626 . . . . 25.0 114.069 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 mmt-85 -106.71 146.38 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.45 109.99 22.07 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.226 0.329 . . . . 25.0 111.08 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -101.53 135.44 43.04 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.964 -1.495 . . . . 25.0 106.964 173.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -113.87 109.46 18.56 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 105.437 -2.061 . . . . 25.0 105.437 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -141.84 -179.44 6.2 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.884 -0.784 . . . . 25.0 108.884 -169.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 88.4 p -136.94 164.67 27.78 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.949 0.722 . . . . 25.0 112.949 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.32 80.94 37.44 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 175.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -82.53 -74.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.03 0 N-CA-C 117.123 1.932 . . . . 25.0 117.123 -173.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 115.29 16.99 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 114.004 1.112 . . . . 25.0 114.004 -172.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.56 11.62 80.29 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.871 -0.68 . . . . 25.0 114.576 173.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.3 mt -133.36 154.73 50.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.202 0.501 . . . . 25.0 110.469 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.7 m -141.46 157.69 21.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 107.96 -1.126 . . . . 25.0 107.96 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -93.79 126.4 38.95 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.728 -0.607 . . . . 25.0 109.799 177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.1 t -106.75 96.3 6.35 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.584 -0.895 . . . . 25.0 108.584 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -60.94 -27.82 68.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 25.0 111.533 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -31.17 72.27 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.03 0.752 . . . . 25.0 113.03 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 2.3 p -103.21 -8.83 20.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.715 0.293 . . . . 25.0 110.879 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 tptt 64.8 23.07 12.64 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.911 0.885 . . . . 25.0 111.481 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.13 169.17 16.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.113 -0.949 . . . . 25.0 111.409 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.2 t -93.35 139.39 30.72 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.911 -1.885 . . . . 25.0 105.911 173.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.3 p -128.4 161.46 29.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.071 0.463 . . . . 25.0 110.537 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.4 t90 -70.51 138.68 51.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 25.0 111.919 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -78.36 132.07 37.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.78 -1.193 . . . . 25.0 107.78 175.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.33 -2.01 50.35 Favored Glycine 0 C--O 1.228 -0.223 0 N-CA-C 111.213 -0.755 . . . . 25.0 111.213 -177.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.58 127.17 30.17 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.677 -1.231 . . . . 25.0 107.677 174.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.4 t -82.43 121.72 78.49 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 -177.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -86.65 9.27 4.06 Favored 'Trans proline' 0 C--N 1.35 0.611 0 N-CA-C 115.066 1.141 . . . . 25.0 115.066 -175.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.244 0.811 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.594 0 CA-C-O 118.331 -1.261 . . . . 25.0 111.528 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 t -151.98 144.05 16.43 Favored Pre-proline 0 C--O 1.24 0.602 0 CA-C-N 118.799 1.3 . . . . 25.0 107.611 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -71.19 139.37 35.24 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 116.887 -1.609 . . . . 25.0 112.991 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.3 p -82.59 7.07 15.64 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.648 0.737 . . . . 25.0 111.037 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -47.76 -52.92 16.88 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.21 -1.93 15.94 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.834 0.679 . . . . 25.0 112.834 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -66.75 138.59 57.49 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 120.783 -1.198 . . . . 25.0 109.067 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.03 4.01 90.39 Favored Glycine 0 C--O 1.247 0.919 0 C-N-CA 121.093 -0.575 . . . . 25.0 113.181 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -113.92 154.94 26.69 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 106.075 -1.824 . . . . 25.0 106.075 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.75 151.7 46.94 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.205 -0.665 . . . . 25.0 109.205 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.49 131.68 48.91 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 158.92 -177.42 35.51 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 110.724 -0.95 . . . . 25.0 110.724 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.6 mt -97.32 147.82 23.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.34 . . . . 25.0 110.571 -178.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -134.21 146.65 60.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 109.082 -0.71 . . . . 25.0 109.082 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -71.35 149.44 56.84 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 117.908 -0.928 . . . . 25.0 114.32 -172.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -95.74 129.63 33.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 106.388 -1.708 . . . . 25.0 106.388 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -80.84 -16.71 10.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 N-CA-C 114.884 1.071 . . . . 25.0 114.884 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -92.53 -39.08 11.57 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.727 0.411 . . . . 25.0 111.219 -176.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -110.54 171.7 7.3 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.717 0.77 . . . . 25.0 109.957 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -109.63 -36.48 5.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.655 -0.702 . . . . 25.0 112.81 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 t -86.9 -26.09 24.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.743 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 55.6 p -89.39 158.77 17.63 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 121.367 -0.833 . . . . 25.0 110.698 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -139.26 169.54 17.58 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.538 0.685 . . . . 25.0 109.3 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -103.56 150.03 24.32 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 102.914 -2.995 . . . . 25.0 102.914 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.8 t -140.13 141.2 36.1 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t -117.05 122.51 44.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.16 120.26 12.87 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.79 34.91 24.36 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.8 0.809 . . . . 25.0 112.01 -177.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.91 3.56 84.49 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.956 -0.566 . . . . 25.0 114.478 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -102.05 138.8 38.53 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.046 -1.094 . . . . 25.0 108.046 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.58 119.22 26.6 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.983 -0.747 . . . . 25.0 108.983 178.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -109.58 143.66 38.97 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.32 -1.733 . . . . 25.0 106.32 172.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -128.66 116.79 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.203 -2.147 . . . . 25.0 105.203 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -145.3 169.07 18.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.252 0.478 . . . . 25.0 110.464 -172.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 60.6 p -107.6 157.81 17.75 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.998 0.519 . . . . 25.0 111.64 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.17 88.3 31.9 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 107.391 -1.337 . . . . 25.0 107.391 173.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.77 -78.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.29 0 N-CA-C 119.486 2.841 . . . . 25.0 119.486 -170.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.08 96.39 1.06 Allowed 'General case' 0 C--O 1.242 0.66 0 N-CA-C 116.534 2.05 . . . . 25.0 116.534 -166.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.81 13.21 83.29 Favored Glycine 0 C--O 1.22 -0.749 0 CA-C-N 114.978 -1.01 . . . . 25.0 112.568 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.6 mt -107.03 137.75 44.5 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.638 0.732 . . . . 25.0 112.697 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.3 m -133.09 147.87 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.417 -0.81 . . . . 25.0 110.241 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -90.88 134.7 34.26 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.132 0.491 . . . . 25.0 110.732 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.7 t -114.02 102.68 10.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.649 1.214 . . . . 25.0 109.705 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.38 -24.18 64.75 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.688 0.996 . . . . 25.0 113.688 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 p -64.93 -35.63 81.77 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 111.689 0.255 . . . . 25.0 111.689 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.3 p -110.91 -2.54 15.99 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 113.706 1.002 . . . . 25.0 113.706 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 61.85 33.38 17.68 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.716 0.807 . . . . 25.0 111.152 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -113.52 166.72 11.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.091 0.472 . . . . 25.0 109.758 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -114.68 129.44 56.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 102.97 -2.974 . . . . 25.0 102.97 165.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.9 p -124.51 157.68 34.73 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.727 -0.471 . . . . 25.0 109.727 -174.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -79.97 145.01 32.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.596 -0.89 . . . . 25.0 108.596 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -80.37 82.1 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.501 0.667 . . . . 25.0 112.591 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -93.2 24.7 23.83 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.796 -0.638 . . . . 25.0 112.843 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.6 tt -66.72 132.77 48.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 117.207 0.503 . . . . 25.0 109.752 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -113.84 121.46 36.96 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 107.177 -1.416 . . . . 25.0 107.177 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -89.47 15.49 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 121.012 1.141 . . . . 25.0 113.662 -174.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 . . . . . 0 C--O 1.246 0.908 0 N-CA-C 108.682 -0.859 . . . . 25.0 108.682 -178.391 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 118.993 -0.893 . . . . 25.0 111.291 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.7 m -81.01 146.16 58.48 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 118.203 1.002 . . . . 25.0 110.323 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.26 142.47 41.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 116.788 -1.675 . . . . 25.0 111.85 176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.4 p -81.39 -10.79 59.46 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 120.873 0.368 . . . . 25.0 111.956 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 31' ' ' LEU . 72.3 t80 -57.83 -31.08 66.29 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.082 1.142 . . . . 25.0 114.082 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 m -111.69 2.0 17.0 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.654 0.613 . . . . 25.0 112.654 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -78.95 134.14 36.85 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.878 -1.527 . . . . 25.0 106.878 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.62 4.29 89.14 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.767 -0.73 . . . . 25.0 112.008 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -113.32 148.96 34.65 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 176.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 150.79 43.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.048 -1.834 . . . . 25.0 106.048 173.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.06 150.02 48.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.796 -1.187 . . . . 25.0 107.796 176.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -171.44 24.3 Favored Glycine 0 C--O 1.237 0.294 0 N-CA-C 110.241 -1.143 . . . . 25.0 110.241 -176.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.414 HD22 ' CD2' ' A' ' 23' ' ' PHE . 29.7 mt -105.94 141.0 38.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.558 0.694 . . . . 25.0 112.464 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -124.4 150.3 63.93 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -67.75 147.4 75.35 Favored 'Trans proline' 0 C--N 1.35 0.625 0 N-CA-C 114.325 0.856 . . . . 25.0 114.325 -176.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -92.04 154.96 43.41 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 114.86 -1.064 . . . . 25.0 111.175 -177.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.0 -33.24 19.97 Favored 'Trans proline' 0 CA--C 1.545 1.049 0 N-CA-C 116.71 1.773 . . . . 25.0 116.71 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -162.3 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 113.698 0.999 . . . . 25.0 113.698 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 36.25 -105.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.718 1.377 . . . . 25.0 114.718 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 -61.86 0.12 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.088 0.471 . . . . 25.0 111.545 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.7 p -150.94 37.94 0.65 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.169 0.985 . . . . 25.0 110.243 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 78.0 p -98.8 168.91 9.83 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.478 -1.237 . . . . 25.0 109.662 -179.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.414 ' CD2' HD22 ' A' ' 13' ' ' LEU . 7.9 p90 -145.68 172.73 12.85 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.848 -0.797 . . . . 25.0 108.848 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -102.76 137.17 41.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 102.86 -3.015 . . . . 25.0 102.86 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.1 t -126.72 135.47 51.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.8 m -113.69 127.75 56.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.545 -1.65 . . . . 25.0 106.545 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.48 122.12 12.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.52 31.59 17.39 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 124.07 0.948 . . . . 25.0 110.969 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.37 11.83 79.86 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.864 -0.607 . . . . 25.0 114.231 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -108.9 151.1 26.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.174 -1.047 . . . . 25.0 108.174 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 5' ' ' PHE . 49.5 tp -92.29 129.51 38.21 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.317 0.385 . . . . 25.0 111.907 -178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -122.69 134.11 54.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.342 -2.096 . . . . 25.0 105.342 167.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -113.95 112.69 23.72 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 104.852 -2.277 . . . . 25.0 104.852 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -140.44 173.44 11.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.577 -0.527 . . . . 25.0 109.577 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 84.5 p -122.51 159.51 27.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.737 1.014 . . . . 25.0 113.737 -177.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.89 72.11 62.49 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 107.444 -1.317 . . . . 25.0 107.444 177.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -82.88 -60.67 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.753 0 N-CA-C 117.62 2.123 . . . . 25.0 117.62 -170.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 p -80.63 111.04 16.69 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.938 1.088 . . . . 25.0 113.938 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.33 14.91 76.98 Favored Glycine 0 C--O 1.221 -0.684 0 C-N-CA 120.706 -0.759 . . . . 25.0 113.795 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.7 mt -124.93 149.57 47.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.782 0.791 . . . . 25.0 112.225 -171.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 m -139.16 148.77 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 122.839 0.456 . . . . 25.0 109.87 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -93.41 131.41 38.62 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.979 -0.451 . . . . 25.0 110.003 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.6 t -115.97 109.18 17.21 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.628 -0.879 . . . . 25.0 108.628 176.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -65.69 -28.27 68.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.367 0.506 . . . . 25.0 112.367 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.1 p -70.62 -34.57 72.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.687 0.28 . . . . 25.0 110.494 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.7 t -79.38 -21.85 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.655 -0.498 . . . . 25.0 109.655 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 59.31 29.73 19.33 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.412 -0.959 . . . . 25.0 108.412 -171.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.9 p -144.55 168.46 20.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.114 -0.948 . . . . 25.0 110.126 -174.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.1 t -105.23 134.77 47.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.714 -1.958 . . . . 25.0 105.714 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.8 p -121.03 159.9 24.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.935 0.398 . . . . 25.0 110.056 -176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -72.9 136.17 45.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -73.07 149.4 43.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.668 -0.493 . . . . 25.0 109.668 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.66 14.46 61.34 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 121.051 -0.595 . . . . 25.0 112.357 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.5 tp -62.36 122.92 16.9 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.297 -0.631 . . . . 25.0 109.297 176.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.2 t -84.28 122.79 75.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 107.88 -1.156 . . . . 25.0 107.88 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -74.75 -13.86 21.91 Favored 'Trans proline' 0 C--N 1.351 0.687 0 N-CA-C 114.828 1.049 . . . . 25.0 114.828 -177.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 124.457 1.103 . . . . 25.0 110.086 -177.729 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 CA-C-O 118.547 -1.141 . . . . 25.0 111.42 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.6 t -150.4 141.88 15.14 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 107.165 -1.42 . . . . 25.0 107.165 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -74.36 165.03 32.73 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 116.953 -1.564 . . . . 25.0 112.056 178.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p -80.87 1.92 28.74 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.329 0.585 . . . . 25.0 111.298 176.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.41 ' CD1' HD13 ' A' ' 31' ' ' LEU . 60.0 t80 -57.16 -44.6 83.62 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.855 1.058 . . . . 25.0 113.855 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 m -100.91 1.44 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.905 0.383 . . . . 25.0 111.931 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.47 134.64 39.47 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 107.604 -1.258 . . . . 25.0 107.604 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.17 13.72 81.54 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.988 -0.625 . . . . 25.0 112.482 -177.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -118.62 155.59 30.7 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.915 -1.143 . . . . 25.0 107.915 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.85 155.87 28.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 105.586 -2.005 . . . . 25.0 105.586 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -70.23 148.74 48.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.69 -1.226 . . . . 25.0 107.69 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.81 -173.39 24.05 Favored Glycine 0 C--O 1.238 0.394 0 N-CA-C 110.037 -1.225 . . . . 25.0 110.037 -176.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 23' ' ' PHE . 46.7 mt -96.49 153.7 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.611 0.706 . . . . 25.0 110.551 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -135.46 149.02 68.33 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 107.925 -1.139 . . . . 25.0 107.925 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -67.11 144.31 68.83 Favored 'Trans proline' 0 C--N 1.355 0.904 0 N-CA-C 115.632 1.359 . . . . 25.0 115.632 -173.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 p-10 -83.73 154.22 64.83 Favored Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.83 -24.21 2.3 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 N-CA-C 118.442 2.439 . . . . 25.0 118.442 -172.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -140.48 -36.45 0.48 Allowed 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.641 2.089 . . . . 25.0 116.641 -170.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 19.6 mp0 -76.91 176.71 8.33 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.711 -0.677 . . . . 25.0 111.341 -172.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -69.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.744 1.016 . . . . 25.0 113.744 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -113.61 16.59 18.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.054 1.502 . . . . 25.0 115.054 -172.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.4 p -79.93 172.01 14.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.363 -0.976 . . . . 25.0 108.363 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.408 ' CD2' HD22 ' A' ' 13' ' ' LEU . 8.9 p90 -156.61 170.73 21.72 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.37 0.605 . . . . 25.0 110.332 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -103.66 150.03 24.39 Favored 'General case' 0 CA--C 1.502 -0.866 0 N-CA-C 103.104 -2.924 . . . . 25.0 103.104 170.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.6 t -133.99 133.07 40.87 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.2 m -107.85 127.35 53.64 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.712 -1.958 . . . . 25.0 105.712 174.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.98 121.55 14.18 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.104 -1.443 . . . . 25.0 107.104 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.09 31.88 19.02 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.875 0.87 . . . . 25.0 110.034 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.54 9.55 69.26 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.885 -0.598 . . . . 25.0 114.533 -178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -103.56 150.01 24.35 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.064 -1.087 . . . . 25.0 108.064 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.41 HD13 ' CD1' ' A' ' 5' ' ' PHE . 54.1 tp -91.3 130.01 37.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.39 0.515 . . . . 25.0 112.39 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -122.86 134.74 54.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.74 -1.948 . . . . 25.0 105.74 167.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -113.94 123.31 49.44 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 104.959 -2.237 . . . . 25.0 104.959 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -138.57 161.31 37.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.959 0.409 . . . . 25.0 111.19 -174.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.0 p -110.43 141.22 43.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 177.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -98.99 127.81 33.99 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 102.909 -2.997 . . . . 25.0 102.909 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.74 -106.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 N-CA-C 116.052 1.52 . . . . 25.0 116.052 -166.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.2 t -105.58 152.82 22.6 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.448 -0.783 . . . . 25.0 112.372 -174.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.62 2.4 64.02 Favored Glycine 0 C--O 1.235 0.206 0 N-CA-C 114.767 0.667 . . . . 25.0 114.767 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 51' ' ' TRP . 48.2 mt -131.58 155.28 47.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 25.0 111.279 -174.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.85 157.28 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 107.643 -1.244 . . . . 25.0 107.643 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -82.74 130.29 35.1 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.2 t -115.94 109.79 18.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.512 0.672 . . . . 25.0 109.631 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.49 -25.66 68.09 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.324 0.861 . . . . 25.0 113.324 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.4 p -66.5 -38.11 86.53 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.922 0.712 . . . . 25.0 112.922 -175.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.1 p -104.02 -8.23 19.72 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.391 -0.596 . . . . 25.0 109.391 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.4 tptt 63.29 33.01 14.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.108 -0.951 . . . . 25.0 112.044 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 163.84 20.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.424 -0.807 . . . . 25.0 110.271 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -86.86 125.13 33.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 102.898 -3.001 . . . . 25.0 102.898 165.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.2 p -121.24 161.75 21.41 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.401 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.9 t90 -65.59 136.88 56.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.094 -0.957 . . . . 25.0 110.849 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -83.58 30.09 0.5 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.338 0.866 . . . . 25.0 113.338 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 55.47 45.26 84.55 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 116.002 1.161 . . . . 25.0 116.002 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 tt -63.65 126.89 29.04 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.002 -0.705 . . . . 25.0 109.571 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.61 118.72 71.71 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 107.52 -1.289 . . . . 25.0 107.52 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.93 -5.49 16.41 Favored 'Trans proline' 0 C--N 1.353 0.789 0 N-CA-C 114.765 1.025 . . . . 25.0 114.765 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 . . . . . 0 C--O 1.248 0.998 0 CA-C-O 116.716 -1.611 . . . . 25.0 110.41 -178.801 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 118.858 -0.968 . . . . 25.0 111.399 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t -150.64 147.14 20.61 Favored Pre-proline 0 N--CA 1.468 0.445 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.1 146.55 58.45 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 115.997 -2.202 . . . . 25.0 112.283 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.7 p -106.05 6.5 31.2 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.927 -0.579 . . . . 25.0 110.789 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.26 -35.84 60.48 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.756 1.762 . . . . 25.0 115.756 -174.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.7 t -105.11 -6.61 19.76 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.121 0.486 . . . . 25.0 111.244 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -71.83 127.45 32.59 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.264 -0.898 . . . . 25.0 109.138 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.55 5.39 88.46 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.977 -0.63 . . . . 25.0 113.28 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -107.68 145.51 33.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 117.475 0.637 . . . . 25.0 110.11 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.15 153.71 41.49 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.145 -1.057 . . . . 25.0 108.145 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -67.21 160.45 26.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.079 -0.51 . . . . 25.0 109.721 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.54 16.5 Favored Glycine 0 C--O 1.235 0.158 0 N-CA-C 110.601 -0.999 . . . . 25.0 110.601 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 mt -96.38 147.27 23.99 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -129.77 151.72 78.61 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 106.201 -1.778 . . . . 25.0 106.201 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.59 144.44 60.52 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 117.799 -1.001 . . . . 25.0 113.815 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -80.99 158.08 70.58 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.875 0.87 . . . . 25.0 112.598 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -86.52 -23.67 1.72 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 N-CA-C 119.093 2.69 . . . . 25.0 119.093 -172.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -136.29 -44.72 0.62 Allowed 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 115.588 1.699 . . . . 25.0 115.588 -170.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -71.24 166.37 21.69 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.69 -1.141 . . . . 25.0 111.326 -173.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.9 tpt85 -77.2 -39.51 48.45 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.696 0.998 . . . . 25.0 113.696 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -128.39 3.73 5.68 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 118.95 2.944 . . . . 25.0 118.95 -167.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.8 p -85.89 178.07 7.41 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.301 -1.5 . . . . 25.0 109.265 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -143.14 170.98 14.71 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.456 0.646 . . . . 25.0 109.792 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -101.42 144.52 30.11 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 101.727 -3.434 . . . . 25.0 101.727 167.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -135.56 136.67 41.31 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 107.659 -1.237 . . . . 25.0 107.659 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.97 129.9 56.03 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.78 117.62 8.75 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.62 33.96 22.25 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.74 0.816 . . . . 25.0 110.815 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.75 5.49 74.52 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.299 -0.477 . . . . 25.0 114.179 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -100.87 144.59 29.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.243 -1.021 . . . . 25.0 108.243 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -91.31 128.67 37.23 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.289 -0.414 . . . . 25.0 111.61 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.27 133.74 55.15 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 169.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -116.21 107.81 15.34 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 104.88 -2.267 . . . . 25.0 104.88 175.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -146.5 172.84 12.95 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 120.469 0.176 . . . . 25.0 110.971 -169.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.5 p -114.17 164.13 14.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 171.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.55 127.64 55.82 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 106.782 -1.562 . . . . 25.0 106.782 178.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.33 -52.05 0.93 Allowed 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 116.489 -1.874 . . . . 25.0 116.335 -172.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.78 131.23 53.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.984 0.735 . . . . 25.0 112.984 -178.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.34 22.75 78.56 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.213 -0.994 . . . . 25.0 115.191 168.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.44 118.98 3.67 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -149.36 157.27 6.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 102.755 -3.054 . . . . 25.0 102.755 160.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -119.92 132.3 55.49 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.8 t -116.34 111.89 20.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.925 -0.768 . . . . 25.0 108.925 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -62.75 -30.42 71.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.596 -0.729 . . . . 25.0 111.991 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.3 p -67.78 -33.09 74.14 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 112.655 0.613 . . . . 25.0 112.655 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.1 -5.61 43.85 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.694 -0.484 . . . . 25.0 109.694 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.95 29.09 17.11 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.582 0.753 . . . . 25.0 109.671 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -141.88 166.57 24.35 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 113.663 0.986 . . . . 25.0 113.663 -167.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.8 t -79.91 138.48 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.685 -1.598 . . . . 25.0 106.685 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.3 p -124.33 167.98 13.61 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.939 -1.504 . . . . 25.0 106.939 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -95.67 145.05 25.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.07 0.462 . . . . 25.0 109.97 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -80.44 96.69 6.81 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.896 0.702 . . . . 25.0 112.896 -174.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.31 3.89 90.38 Favored Glycine 0 C--O 1.228 -0.253 0 CA-C-N 115.81 -0.632 . . . . 25.0 114.532 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.26 156.72 46.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 122.35 -0.5 . . . . 25.0 110.342 -178.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 91.3 t -105.88 111.34 64.57 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 105.53 -2.026 . . . . 25.0 105.53 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -89.69 16.47 1.74 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 120.587 0.858 . . . . 25.0 113.389 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 . . . . . 0 C--O 1.241 0.607 0 CA-C-O 117.984 -1.007 . . . . 25.0 109.739 -177.512 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 118.064 -1.409 . . . . 25.0 111.19 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 t 52.18 70.73 1.74 Allowed Pre-proline 0 N--CA 1.479 1.013 0 N-CA-C 113.876 1.065 . . . . 25.0 113.876 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -70.52 151.97 65.06 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 116.597 -1.802 . . . . 25.0 112.943 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.2 p -77.58 2.94 14.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.283 0.564 . . . . 25.0 111.904 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -56.94 -43.67 81.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.8 t -108.67 -16.41 14.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.386 0.613 . . . . 25.0 111.316 -178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -67.45 127.72 33.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 O-C-N 120.909 -1.119 . . . . 25.0 110.984 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.76 20.25 74.13 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 120.963 -0.637 . . . . 25.0 112.849 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -118.07 161.89 19.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.49 39.73 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.134 -1.802 . . . . 25.0 106.134 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -66.87 146.08 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.227 -1.397 . . . . 25.0 107.227 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.05 -178.36 25.69 Favored Glycine 0 C--N 1.322 -0.239 0 N-CA-C 110.993 -0.843 . . . . 25.0 110.993 -176.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 23' ' ' PHE . 26.2 mt -96.46 144.78 26.25 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.213 0.53 . . . . 25.0 112.023 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -131.7 154.28 81.76 Favored Pre-proline 0 C--N 1.322 -0.62 0 N-CA-C 108.638 -0.875 . . . . 25.0 108.638 -177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.11 137.59 37.74 Favored 'Trans proline' 0 C--N 1.351 0.663 0 N-CA-C 115.802 1.424 . . . . 25.0 115.802 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -83.51 159.2 61.88 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 125.121 1.368 . . . . 25.0 111.476 -178.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.58 -24.8 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 N-CA-C 118.408 2.426 . . . . 25.0 118.408 -172.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -147.42 -44.41 0.17 Allowed 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.779 2.14 . . . . 25.0 116.779 -171.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -68.72 162.49 26.04 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 113.488 0.921 . . . . 25.0 113.488 -168.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -82.61 -34.54 27.59 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.233 0.827 . . . . 25.0 113.233 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.1 t -107.91 -21.71 12.73 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.426 1.639 . . . . 25.0 115.426 -170.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 80.5 p -82.56 164.03 21.11 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.342 -0.848 . . . . 25.0 112.706 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.426 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.2 p90 -142.38 174.27 10.77 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -104.64 146.45 28.91 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 102.75 -3.056 . . . . 25.0 102.75 168.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.3 t -132.46 134.46 45.1 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.23 -1.396 . . . . 25.0 107.23 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.1 t -110.96 119.93 40.71 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 102.071 -3.307 . . . . 25.0 102.071 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.77 121.67 11.31 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.295 -0.631 . . . . 25.0 109.295 -175.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.36 31.23 18.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.057 0.943 . . . . 25.0 110.99 -176.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.55 8.43 84.06 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.149 -0.548 . . . . 25.0 113.689 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.72 151.43 30.26 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.642 -0.503 . . . . 25.0 109.642 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.29 132.27 34.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.976 -0.556 . . . . 25.0 111.343 -177.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -128.67 139.1 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.264 -1.754 . . . . 25.0 106.264 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -121.23 111.38 17.31 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.296 -2.113 . . . . 25.0 105.296 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.62 176.4 8.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.792 -0.818 . . . . 25.0 108.792 -171.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 75.5 p -124.28 156.38 37.02 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 115.477 1.658 . . . . 25.0 115.477 -174.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -112.27 98.0 41.5 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.191 -1.411 . . . . 25.0 107.191 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.44 -91.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.302 0 N-CA-C 117.146 1.941 . . . . 25.0 117.146 -172.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -77.34 115.79 17.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 115.197 1.555 . . . . 25.0 115.197 -171.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 2.68 55.53 Favored Glycine 0 C--O 1.227 -0.312 0 N-CA-C 115.332 0.893 . . . . 25.0 115.332 172.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -105.1 134.66 47.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.108 0.454 . . . . 25.0 110.064 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -126.5 146.1 32.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -81.9 132.64 35.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -118.89 109.33 15.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.014 0.912 . . . . 25.0 108.634 176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.99 -26.7 68.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.46 -0.791 . . . . 25.0 112.88 -176.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p -67.8 -29.76 69.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.542 0.571 . . . . 25.0 112.542 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 32.0 p -103.68 -5.3 22.72 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 121.425 -0.11 . . . . 25.0 111.225 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 54.66 39.44 31.26 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.6 p -146.88 168.77 20.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.57 -0.741 . . . . 25.0 110.299 -172.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 137.98 38.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.227 -1.768 . . . . 25.0 106.227 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -124.46 149.96 46.24 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.742 0.306 . . . . 25.0 110.201 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -72.98 135.01 44.92 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.846 -1.168 . . . . 25.0 107.846 174.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -84.66 67.59 10.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.144 0.497 . . . . 25.0 110.458 177.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.1 56.05 0.72 Allowed Glycine 0 C--O 1.223 -0.538 0 N-CA-C 110.996 -0.842 . . . . 25.0 110.996 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.11 131.42 49.47 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.86 0.362 . . . . 25.0 111.396 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -121.23 126.5 26.54 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 106.331 -1.729 . . . . 25.0 106.331 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -88.46 11.86 2.96 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 N-CA-C 114.892 1.074 . . . . 25.0 114.892 -174.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.243 0.744 0 N-CA-C 108.229 -1.026 . . . . 25.0 108.229 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.141 0 CA-C-O 119.185 -0.786 . . . . 25.0 111.507 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.2 m -136.51 153.15 75.89 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.32 144.69 46.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 116.011 -2.192 . . . . 25.0 112.022 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.9 p -75.13 -12.58 60.34 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-O 121.324 0.583 . . . . 25.0 110.502 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -55.69 -29.4 59.34 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.997 1.11 . . . . 25.0 113.997 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.2 t -112.31 -10.56 13.79 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.204 0.526 . . . . 25.0 112.396 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -72.68 126.68 30.47 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.327 -0.858 . . . . 25.0 109.376 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.04 2.1 84.04 Favored Glycine 0 C--O 1.225 -0.451 0 C-N-CA 121.302 -0.475 . . . . 25.0 113.004 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -101.03 147.56 26.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 O-C-N 122.264 -0.551 . . . . 25.0 111.839 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.13 161.47 26.87 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.872 -1.159 . . . . 25.0 107.872 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -72.32 179.8 3.25 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.228 0.537 . . . . 25.0 110.803 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.28 -176.63 24.55 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 112.046 -0.422 . . . . 25.0 112.046 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.76 145.76 25.52 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.006 0.432 . . . . 25.0 111.834 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.67 147.2 57.56 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 108.997 -0.742 . . . . 25.0 108.997 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.76 155.62 65.44 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 114.661 0.985 . . . . 25.0 114.661 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -95.24 153.81 39.61 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.129 0.972 . . . . 25.0 110.903 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.05 -26.57 10.7 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 117.149 -1.434 . . . . 25.0 115.711 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -163.76 -78.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.232 0.469 . . . . 25.0 111.258 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 38.62 -129.22 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.142 0.977 . . . . 25.0 112.297 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -136.43 -55.93 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.486 0.714 . . . . 25.0 110.152 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 m -156.56 47.4 0.45 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.161 0.43 . . . . 25.0 112.161 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -133.13 169.7 16.48 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 115.904 -0.589 . . . . 25.0 111.469 -174.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -153.64 174.34 14.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.978 -1.489 . . . . 25.0 106.978 -175.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -105.42 160.83 14.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.57 141.51 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.521 -0.918 . . . . 25.0 108.521 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.6 127.24 55.08 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 128.33 14.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.062 -1.459 . . . . 25.0 107.062 178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.34 30.67 10.58 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.095 0.776 . . . . 25.0 113.095 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.91 9.14 79.31 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.427 -0.416 . . . . 25.0 113.922 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -110.4 147.4 34.09 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.479 -0.934 . . . . 25.0 108.479 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -89.82 130.27 36.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.308 -0.86 . . . . 25.0 110.381 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -120.75 149.54 42.38 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.029 -2.582 . . . . 25.0 104.029 168.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -118.64 137.8 53.03 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 103.051 -2.944 . . . . 25.0 103.051 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -133.61 168.45 18.66 Favored 'General case' 0 CA--C 1.503 -0.863 0 O-C-N 123.293 0.37 . . . . 25.0 110.968 -173.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.0 p -136.9 159.1 42.86 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 102.145 -3.279 . . . . 25.0 102.145 170.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.1 m -123.17 78.54 52.26 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 104.091 -2.559 . . . . 25.0 104.091 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 -47.46 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 116.871 -1.619 . . . . 25.0 115.825 -167.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -100.95 116.21 32.26 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.055 1.131 . . . . 25.0 114.055 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.54 -11.44 6.99 Favored Glycine 0 N--CA 1.463 0.452 0 N-CA-C 118.791 2.277 . . . . 25.0 118.791 170.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.7 mt -120.79 152.66 38.08 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.44 1.12 . . . . 25.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.8 m -136.63 144.33 32.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.634 -0.876 . . . . 25.0 108.634 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.415 ' HA ' ' HA ' ' A' ' 49' ' ' CYS . 19.2 t80 -74.68 127.15 32.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.0 0.429 . . . . 25.0 110.927 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -112.88 111.49 22.29 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 122.033 0.92 . . . . 25.0 108.801 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -63.78 -21.97 66.68 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.781 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.2 p -67.95 -34.92 77.51 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.491 0.552 . . . . 25.0 112.491 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 3.1 p -104.28 -9.78 18.32 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 121.109 -0.236 . . . . 25.0 111.441 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 63.11 33.98 14.07 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.899 0.88 . . . . 25.0 110.591 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -142.83 166.68 23.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.642 -0.708 . . . . 25.0 109.26 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 42' ' ' PHE . 30.7 m -86.8 146.83 26.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 106.735 -1.579 . . . . 25.0 106.735 169.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.17 160.7 27.27 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -67.76 130.18 42.21 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -82.01 103.27 11.53 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.937 1.088 . . . . 25.0 113.937 -173.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.4 -1.07 86.74 Favored Glycine 0 N--CA 1.459 0.183 0 N-CA-C 115.272 0.869 . . . . 25.0 115.272 172.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.02 155.32 27.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.079 -0.66 . . . . 25.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.1 t -85.14 125.93 68.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -88.68 16.1 1.92 Allowed 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.296 1.331 . . . . 25.0 113.969 -177.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 . . . . . 0 C--O 1.248 1.013 0 N-CA-C 108.54 -0.911 . . . . 25.0 108.54 -177.581 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.517 0 CA-C-O 119.06 -0.855 . . . . 25.0 111.35 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -71.5 147.91 92.8 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 107.764 -1.198 . . . . 25.0 107.764 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.24 124.8 11.23 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 116.512 -1.859 . . . . 25.0 113.605 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.6 p -86.24 30.79 0.67 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.33 0.863 . . . . 25.0 113.33 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -62.01 -41.47 98.1 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.747 -0.596 . . . . 25.0 112.465 -177.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.4 -12.0 9.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.576 0.703 . . . . 25.0 111.027 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.65 128.66 37.25 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 121.445 -0.785 . . . . 25.0 110.236 -177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.97 16.41 80.7 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 121.058 -0.592 . . . . 25.0 112.851 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -114.15 148.42 37.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 117.007 0.403 . . . . 25.0 110.647 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.15 150.81 47.11 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.472 -0.936 . . . . 25.0 108.472 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -68.77 164.66 21.31 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.357 0.598 . . . . 25.0 110.677 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.92 -175.13 16.0 Favored Glycine 0 CA--C 1.516 0.113 0 N-CA-C 110.306 -1.118 . . . . 25.0 110.306 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.1 mt -93.59 152.06 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.699 1.0 . . . . 25.0 113.699 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -133.68 148.79 69.95 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.98 145.5 35.82 Favored 'Trans proline' 0 C--N 1.349 0.555 0 N-CA-C 114.281 0.839 . . . . 25.0 114.281 -174.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -102.56 120.34 53.3 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 110.123 -0.325 . . . . 25.0 110.123 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.04 -18.1 14.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 116.31 -1.993 . . . . 25.0 113.808 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -70.34 -52.21 24.37 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 111.977 0.362 . . . . 25.0 111.977 -175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.81 141.07 52.17 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.26 -18.75 44.89 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.338 1.066 . . . . 25.0 108.326 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -77.71 -0.87 28.51 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.292 -1.777 . . . . 25.0 113.323 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 60.7 p -137.65 170.09 16.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.578 0.704 . . . . 25.0 112.172 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -143.52 172.56 12.62 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 25.0 108.741 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -107.79 152.8 23.88 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 102.959 -2.978 . . . . 25.0 102.959 171.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.7 t -140.02 142.75 36.22 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.49 128.91 56.47 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.682 -2.34 . . . . 25.0 104.682 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.55 113.72 6.94 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 107.234 -1.395 . . . . 25.0 107.234 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.35 34.86 24.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.786 0.834 . . . . 25.0 110.189 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.65 -1.49 57.7 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.691 0.636 . . . . 25.0 114.691 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -88.82 150.14 23.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.341 -0.985 . . . . 25.0 108.341 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.85 124.63 37.98 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 123.597 0.56 . . . . 25.0 109.821 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -118.99 136.5 54.07 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.275 -1.38 . . . . 25.0 107.275 172.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -117.28 118.36 32.05 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -142.06 157.92 44.35 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.158 0.435 . . . . 25.0 110.838 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 48.8 p -94.1 162.44 13.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.554 . . . . 25.0 109.886 177.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 44.9 t -114.62 122.63 33.59 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 107.258 -1.386 . . . . 25.0 107.258 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.62 -41.49 0.25 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 115.977 -2.215 . . . . 25.0 117.584 -173.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.1 m -103.66 117.32 34.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 115.653 1.723 . . . . 25.0 115.653 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.17 21.39 79.25 Favored Glycine 0 C--O 1.21 -1.404 0 C-N-CA 120.499 -0.857 . . . . 25.0 113.322 171.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -46.55 104.73 0.05 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 119.851 3.278 . . . . 25.0 119.851 -162.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -149.06 162.69 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 104.507 -2.405 . . . . 25.0 104.507 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -112.22 131.06 55.7 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.774 -0.579 . . . . 25.0 110.802 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 t -107.07 113.72 27.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.474 -0.565 . . . . 25.0 109.474 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.71 -35.32 79.36 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.657 0.614 . . . . 25.0 112.657 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.0 p -69.1 -33.14 73.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 120.769 0.319 . . . . 25.0 111.067 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 46.1 t -81.86 -22.13 37.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.672 -0.492 . . . . 25.0 109.672 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.2 tptt 59.97 26.86 16.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.684 -1.228 . . . . 25.0 107.684 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.0 p -142.03 167.86 21.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.273 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.47 138.06 35.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.0 p -131.39 168.01 18.32 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.905 -0.776 . . . . 25.0 108.905 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.6 m0 -75.64 148.48 38.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.26 -0.645 . . . . 25.0 109.26 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.2 93.51 2.83 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.59 11.75 82.62 Favored Glycine 0 C--O 1.224 -0.491 0 N-CA-C 115.633 1.013 . . . . 25.0 115.633 174.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.7 tp -132.18 136.82 47.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.429 0.615 . . . . 25.0 110.039 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 44.0 t -122.21 125.66 26.51 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -76.72 -23.08 11.37 Favored 'Trans proline' 0 C--N 1.351 0.698 0 N-CA-C 117.389 2.034 . . . . 25.0 117.389 -173.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 . . . . . 0 C--O 1.244 0.772 0 N-CA-C 106.417 -1.697 . . . . 25.0 106.417 -176.966 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.088 0 CA-C-O 118.728 -1.04 . . . . 25.0 111.382 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -137.24 152.83 74.23 Favored Pre-proline 0 N--CA 1.468 0.452 0 N-CA-C 107.774 -1.195 . . . . 25.0 107.774 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.21 136.23 28.76 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 117.13 -1.446 . . . . 25.0 112.689 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p -81.91 -2.02 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.593 0.711 . . . . 25.0 111.824 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.401 ' CD1' HD22 ' A' ' 31' ' ' LEU . 81.8 t80 -63.01 -41.16 99.49 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.8 t -95.99 -17.26 21.13 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.602 0.715 . . . . 25.0 111.007 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -68.16 132.39 47.1 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.069 -1.019 . . . . 25.0 109.071 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.44 12.81 79.83 Favored Glycine 0 C--O 1.226 -0.389 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.303 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -122.27 163.23 20.02 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.235 -1.395 . . . . 25.0 107.235 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.4 32.88 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 106.313 -1.736 . . . . 25.0 106.313 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.44 148.12 49.99 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.127 -1.064 . . . . 25.0 108.127 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.12 -177.28 23.66 Favored Glycine 0 C--O 1.237 0.315 0 N-CA-C 111.23 -0.748 . . . . 25.0 111.23 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.6 mt -96.46 139.75 32.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.146 0.498 . . . . 25.0 110.777 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -125.11 152.85 71.27 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 107.997 -1.112 . . . . 25.0 107.997 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.42 147.42 71.3 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 118.004 -0.864 . . . . 25.0 113.791 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -86.49 159.46 52.86 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 115.145 -0.934 . . . . 25.0 111.585 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -83.86 -20.19 4.6 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 118.032 2.282 . . . . 25.0 118.032 -172.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -146.01 -47.06 0.2 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.171 2.285 . . . . 25.0 117.171 -169.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -72.24 169.99 15.03 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.243 -0.435 . . . . 25.0 111.056 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -81.97 -50.49 9.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.192 1.182 . . . . 25.0 114.192 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 m -112.57 18.59 18.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 116.13 1.9 . . . . 25.0 116.13 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 86.9 p -102.07 165.46 11.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.173 0.442 . . . . 25.0 110.407 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -142.16 174.5 10.55 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.725 -0.843 . . . . 25.0 108.725 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -105.42 136.21 45.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 103.266 -2.865 . . . . 25.0 103.266 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -121.45 120.24 34.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.799 -1.185 . . . . 25.0 107.799 177.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.9 t -103.74 121.39 42.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 105.146 -2.168 . . . . 25.0 105.146 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -148.33 118.59 7.31 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.886 -0.413 . . . . 25.0 109.886 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.38 35.92 24.19 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.714 0.806 . . . . 25.0 112.335 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.01 3.38 84.58 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.071 -0.585 . . . . 25.0 113.639 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -104.74 150.8 24.45 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.053 -1.091 . . . . 25.0 108.053 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.401 HD22 ' CD1' ' A' ' 5' ' ' PHE . 62.7 tp -107.81 132.81 53.01 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.006 -0.739 . . . . 25.0 109.006 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -123.18 134.99 54.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 104.934 -2.247 . . . . 25.0 104.934 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -113.88 108.12 16.63 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 104.932 -2.247 . . . . 25.0 104.932 174.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -135.68 177.06 8.12 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 79.8 p -126.08 168.6 13.76 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -176.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 81.2 m -100.19 98.23 7.37 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 105.739 -1.948 . . . . 25.0 105.739 171.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -84.98 -96.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 0 N-CA-C 116.002 1.501 . . . . 25.0 116.002 -172.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -73.78 114.89 12.57 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.187 -0.945 . . . . 25.0 113.402 -172.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.18 11.54 75.32 Favored Glycine 0 C--O 1.229 -0.209 0 CA-C-N 115.681 -0.691 . . . . 25.0 114.048 174.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 39.5 mt -124.95 153.73 42.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.48 0.64 . . . . 25.0 112.057 -173.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.0 m -139.23 161.66 28.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.021 -1.103 . . . . 25.0 108.021 177.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -93.21 132.75 37.09 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -111.24 101.91 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.249 0.547 . . . . 25.0 109.628 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.47 -19.09 64.44 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.704 1.001 . . . . 25.0 113.704 -175.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 p -71.65 -52.09 19.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.969 -0.457 . . . . 25.0 111.302 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.09 -1.99 32.65 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.034 0.753 . . . . 25.0 113.034 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.0 mptt 64.94 35.13 8.5 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.443 1.097 . . . . 25.0 108.457 177.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.6 m -105.58 157.21 17.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.233 -0.894 . . . . 25.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.1 t -103.26 121.64 43.13 Favored 'General case' 0 C--N 1.321 -0.652 1 N-CA-C 99.807 -4.146 . . . . 25.0 99.807 162.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -141.12 167.82 21.27 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -169.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -63.38 148.74 47.62 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.24 0.543 . . . . 25.0 111.916 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -68.06 1.32 2.83 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 115.601 1.704 . . . . 25.0 115.601 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.64 37.12 46.63 Favored Glycine 0 C--O 1.224 -0.521 0 C-N-CA 120.596 -0.811 . . . . 25.0 113.544 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.3 127.7 33.09 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 122.449 -0.442 . . . . 25.0 111.3 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 88.2 t -119.58 117.91 32.49 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 104.957 -2.238 . . . . 25.0 104.957 175.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.23 -25.4 7.16 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 117.134 -1.444 . . . . 25.0 115.612 -173.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 . . . . . 0 C--O 1.244 0.811 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 -177.43 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 CA-C-O 118.939 -0.923 . . . . 25.0 111.231 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.2 p -150.05 165.19 18.08 Favored Pre-proline 0 C--O 1.238 0.479 0 N-CA-C 106.798 -1.556 . . . . 25.0 106.798 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.41 155.47 46.72 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.225 -1.383 . . . . 25.0 111.063 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 61.72 -0.48 0.41 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.905 1.817 . . . . 25.0 115.905 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -60.33 -39.4 86.91 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.482 -0.761 . . . . 25.0 112.971 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.07 -0.57 15.61 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 112.515 0.561 . . . . 25.0 112.515 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.36 127.33 32.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 108.889 -0.782 . . . . 25.0 108.889 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.22 13.84 82.87 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 121.137 -0.554 . . . . 25.0 112.508 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -104.9 147.12 28.11 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.4 154.16 38.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 106.844 -1.539 . . . . 25.0 106.844 177.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.19 149.4 49.59 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.529 -0.915 . . . . 25.0 108.529 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.72 -175.1 20.46 Favored Glycine 0 C--O 1.234 0.105 0 N-CA-C 111.329 -0.708 . . . . 25.0 111.329 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.405 HD22 ' CD2' ' A' ' 23' ' ' PHE . 42.9 mt -97.93 147.49 24.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 25.0 112.286 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -128.49 147.64 64.83 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 107.729 -1.211 . . . . 25.0 107.729 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -73.57 150.77 46.21 Favored 'Trans proline' 0 C--N 1.346 0.421 0 N-CA-C 114.453 0.905 . . . . 25.0 114.453 -175.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -94.35 121.45 63.53 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.108 -1.071 . . . . 25.0 108.108 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.71 -18.82 21.89 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 116.262 -2.025 . . . . 25.0 113.718 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -88.66 -36.62 16.13 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 111.917 0.34 . . . . 25.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -116.09 149.45 38.94 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 114.328 1.233 . . . . 25.0 114.328 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -79.63 -58.07 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.88 -1.054 . . . . 25.0 112.037 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.8 m -98.0 21.56 10.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 116.124 1.898 . . . . 25.0 116.124 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 54.4 p -134.43 159.47 40.97 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.158 -0.682 . . . . 25.0 109.158 175.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.405 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.1 p90 -138.15 176.27 8.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.487 -0.778 . . . . 25.0 110.767 -172.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -107.85 144.93 34.37 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 104.116 -2.55 . . . . 25.0 104.116 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -130.13 140.2 50.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -120.69 133.05 55.38 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.507 -1.294 . . . . 25.0 107.507 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 109.48 4.47 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.3 36.39 26.96 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.645 0.736 . . . . 25.0 110.635 -177.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.29 -5.5 59.65 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 114.788 0.675 . . . . 25.0 114.788 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 mmt85 -84.15 148.93 26.51 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.251 -1.389 . . . . 25.0 107.251 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 131.46 52.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.963 -0.384 . . . . 25.0 109.963 -177.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -123.54 139.42 54.03 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 107.958 -1.126 . . . . 25.0 107.958 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -119.82 111.71 18.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.375 -1.713 . . . . 25.0 106.375 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -140.27 168.19 20.39 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.902 -0.407 . . . . 25.0 109.902 -173.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 62.1 p -112.2 159.5 18.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.088 0.774 . . . . 25.0 113.088 -176.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.86 90.12 50.2 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 105.434 -2.062 . . . . 25.0 105.434 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -79.79 -89.17 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 N-CA-C 117.053 1.905 . . . . 25.0 117.053 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -77.23 115.13 16.76 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.695 1.369 . . . . 25.0 114.695 -169.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 1.01 50.04 Favored Glycine 0 CA--C 1.519 0.304 0 N-CA-C 115.23 0.852 . . . . 25.0 115.23 174.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -103.71 134.31 47.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.795 0.331 . . . . 25.0 110.482 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.3 m -131.6 147.17 32.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.138 0.494 . . . . 25.0 110.12 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -80.61 135.83 36.13 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.629 -0.508 . . . . 25.0 109.629 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.6 t -109.45 101.54 10.49 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 107.866 -1.161 . . . . 25.0 107.866 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.37 -27.82 67.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.531 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 p -70.03 -41.26 74.48 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.224 0.453 . . . . 25.0 112.224 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.6 p -96.74 -10.47 26.75 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 -175.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mptt 66.4 31.11 8.45 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.183 0.993 . . . . 25.0 109.232 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.16 163.04 27.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.635 -0.711 . . . . 25.0 109.441 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.7 t -106.87 138.69 42.56 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 104.162 -2.533 . . . . 25.0 104.162 173.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -141.0 164.36 30.48 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.749 -0.463 . . . . 25.0 109.749 -174.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.2 t90 -71.54 147.45 47.67 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.667 -1.234 . . . . 25.0 107.667 175.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -61.95 122.75 16.25 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.249 -0.649 . . . . 25.0 109.249 178.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.89 -9.67 84.1 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 115.193 0.837 . . . . 25.0 115.193 -175.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.0 tp -83.8 107.25 16.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.956 0.878 . . . . 25.0 109.824 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.422 HG12 ' H ' ' A' ' 57' ' ' ARG . 45.5 t -112.22 125.41 30.18 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.287 -1.005 . . . . 25.0 108.287 -177.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.23 17.66 1.58 Allowed 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 121.471 1.447 . . . . 25.0 113.898 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' H ' HG12 ' A' ' 55' ' ' VAL . 82.6 mtp180 . . . . . 0 CA--C 1.505 -0.755 0 CA-C-O 118.368 -0.825 . . . . 25.0 109.512 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 118.832 -0.982 . . . . 25.0 111.379 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -146.8 151.85 43.16 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 105.158 -2.164 . . . . 25.0 105.158 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.13 111.19 2.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 116.015 -2.19 . . . . 25.0 112.069 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.8 p -60.32 -23.65 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.286 0.565 . . . . 25.0 112.219 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -59.4 -33.49 71.28 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 t -105.62 -11.38 16.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.287 0.565 . . . . 25.0 111.403 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -71.95 132.2 44.0 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.35 14.89 77.8 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.906 -0.664 . . . . 25.0 111.904 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -110.24 143.59 40.17 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.156 -0.683 . . . . 25.0 109.156 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.1 152.62 36.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 104.351 -2.463 . . . . 25.0 104.351 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -68.01 149.47 49.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.055 -0.72 . . . . 25.0 109.055 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.48 -176.11 21.61 Favored Glycine 0 N--CA 1.459 0.216 0 N-CA-C 110.88 -0.888 . . . . 25.0 110.88 -177.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.3 mt -94.71 145.51 24.8 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.88 0.84 . . . . 25.0 110.32 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -127.92 150.32 73.18 Favored Pre-proline 0 C--O 1.238 0.482 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.245 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.49 148.97 74.13 Favored 'Trans proline' 0 C--N 1.352 0.724 0 N-CA-C 114.127 0.78 . . . . 25.0 114.127 -178.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB3' ' HA ' ' A' ' 23' ' ' PHE . 12.6 p-10 -102.71 150.54 37.8 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 114.869 -1.06 . . . . 25.0 111.448 -173.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.01 -30.0 7.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 N-CA-C 116.578 1.722 . . . . 25.0 116.578 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -78.34 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.931 0.787 . . . . 25.0 112.243 -176.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 34.43 -120.12 0.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.828 1.251 . . . . 25.0 113.262 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.6 tpt180 -155.82 -56.99 0.09 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.789 0.662 . . . . 25.0 112.789 177.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.1 m -153.68 39.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 p -137.93 157.27 46.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 -174.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.456 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 0.1 OUTLIER -149.42 175.9 11.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.398 -0.819 . . . . 25.0 108.88 -167.126 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -98.56 154.32 18.0 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.615 -0.883 . . . . 25.0 108.615 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -139.81 131.85 27.9 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -110.28 134.33 52.36 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 106.144 -1.798 . . . . 25.0 106.144 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.09 126.89 11.79 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.36 31.35 14.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.545 0.738 . . . . 25.0 111.895 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.16 69.75 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 115.434 0.934 . . . . 25.0 115.434 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -112.26 149.96 31.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 118.218 1.009 . . . . 25.0 108.483 177.18 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.95 133.65 33.92 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.226 0.824 . . . . 25.0 113.226 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.47 ' CE1' ' HD2' ' A' ' 30' ' ' ARG . 63.7 m-85 -117.33 146.64 43.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.463 -2.421 . . . . 25.0 104.463 165.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -117.23 131.58 56.82 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.562 -2.755 . . . . 25.0 103.562 169.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -136.88 169.41 17.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.6 0.593 . . . . 25.0 112.6 -168.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -136.31 157.79 45.96 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 101.082 -3.674 . . . . 25.0 101.082 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.8 m -106.45 108.3 61.57 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 103.9 -2.63 . . . . 25.0 103.9 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.35 -51.38 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.482 -1.878 . . . . 25.0 116.917 -164.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -105.75 114.47 28.65 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 115.663 1.727 . . . . 25.0 115.663 -172.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.69 4.04 37.55 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 117.66 1.824 . . . . 25.0 117.66 167.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -118.65 146.69 44.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.462 0.631 . . . . 25.0 111.117 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.07 151.04 33.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.069 -1.086 . . . . 25.0 108.069 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -80.32 118.89 22.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.343 0.592 . . . . 25.0 111.101 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.1 t -95.97 105.85 17.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.818 -1.179 . . . . 25.0 107.818 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -62.35 -28.88 70.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.528 0.566 . . . . 25.0 112.528 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -71.73 -33.48 68.75 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.936 -0.306 . . . . 25.0 111.148 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 51.9 t -84.6 -23.13 29.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 25.0 111.99 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 60.23 30.35 19.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 108.399 -0.963 . . . . 25.0 108.399 -170.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 10.4 p -143.3 165.04 28.58 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.241 -0.89 . . . . 25.0 108.851 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.45 136.47 33.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.706 -1.59 . . . . 25.0 106.706 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 34.0 p -121.16 158.9 26.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.201 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 -62.81 132.57 52.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.861 -1.163 . . . . 25.0 107.861 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -74.99 122.37 23.39 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.549 -0.46 . . . . 25.0 110.933 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.71 162.5 11.96 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 108.225 -1.95 . . . . 25.0 108.225 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.1 142.04 47.19 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 106.927 -1.508 . . . . 25.0 106.927 178.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.7 t -85.98 113.1 49.92 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 108.336 -0.987 . . . . 25.0 108.336 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -90.56 6.68 3.91 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 N-CA-C 116.34 1.631 . . . . 25.0 116.34 -172.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 117.996 -1.002 . . . . 25.0 109.511 -177.517 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 CA-C-O 118.346 -1.252 . . . . 25.0 111.477 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.32 153.26 81.6 Favored Pre-proline 0 N--CA 1.471 0.577 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -59.51 133.51 52.35 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.065 1.141 . . . . 25.0 115.065 -174.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.41 -15.94 61.46 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 122.024 0.916 . . . . 25.0 111.704 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.41 -40.69 71.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.513 -1.221 . . . . 25.0 111.684 173.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.4 t -114.02 -3.82 13.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.521 0.563 . . . . 25.0 112.521 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -63.29 117.68 6.95 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 120.534 -1.354 . . . . 25.0 109.473 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.95 17.39 78.5 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 116.556 -0.293 . . . . 25.0 113.669 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -91.89 145.41 24.57 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.37 148.51 51.53 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 106.862 -1.533 . . . . 25.0 106.862 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -68.24 144.25 54.97 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.63 -177.1 21.48 Favored Glycine 0 C--O 1.242 0.633 0 N-CA-C 109.765 -1.334 . . . . 25.0 109.765 -176.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 23' ' ' PHE . 27.9 mt -96.66 151.8 19.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.264 1.03 . . . . 25.0 112.092 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -132.01 153.45 81.37 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 114.869 -1.059 . . . . 25.0 110.21 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.6 143.44 38.07 Favored 'Trans proline' 0 C--N 1.354 0.851 0 N-CA-C 116.11 1.542 . . . . 25.0 116.11 -174.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -88.73 158.61 47.69 Favored Pre-proline 0 CA--C 1.555 1.167 0 CA-C-N 114.877 -1.056 . . . . 25.0 111.539 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.62 -18.71 3.02 Favored 'Trans proline' 0 C--N 1.353 0.813 0 N-CA-C 118.927 2.626 . . . . 25.0 118.927 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -133.95 -59.77 0.83 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 117.124 2.268 . . . . 25.0 117.124 -172.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -70.38 161.46 30.43 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 114.463 1.283 . . . . 25.0 114.463 -167.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -64.81 -41.97 95.38 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 115.654 1.724 . . . . 25.0 115.654 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.9 m -129.34 3.35 5.14 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.118 1.895 . . . . 25.0 116.118 -173.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.4 p -77.71 165.29 24.41 Favored 'General case' 0 C--O 1.212 -0.874 0 O-C-N 121.208 -0.933 . . . . 25.0 110.122 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.461 ' CD2' HD22 ' A' ' 13' ' ' LEU . 16.5 p90 -148.89 168.69 22.34 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.214 1.007 . . . . 25.0 111.107 177.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -100.98 153.92 19.12 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.882 -2.636 . . . . 25.0 103.882 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.9 t -140.63 149.07 41.83 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 106.785 -1.561 . . . . 25.0 106.785 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m -123.79 129.38 50.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 105.612 -1.995 . . . . 25.0 105.612 176.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.2 119.54 14.74 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.283 -1.006 . . . . 25.0 108.283 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.39 35.38 17.22 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 123.45 0.7 . . . . 25.0 111.965 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.88 14.38 78.47 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.578 0.591 . . . . 25.0 114.578 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -109.48 143.96 38.39 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.57 137.7 37.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.765 0.793 . . . . 25.0 112.684 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -128.95 136.16 49.99 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 106.355 -1.72 . . . . 25.0 106.355 166.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -125.09 113.0 17.16 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 103.891 -2.633 . . . . 25.0 103.891 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -137.14 162.58 33.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.082 0.467 . . . . 25.0 111.418 -170.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -108.36 149.85 28.13 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.162 -0.681 . . . . 25.0 109.162 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.04 120.98 47.17 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 103.322 -2.844 . . . . 25.0 103.322 175.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.45 -84.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 N-CA-C 118.19 2.342 . . . . 25.0 118.19 -165.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.3 m -97.53 114.96 26.95 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.896 1.813 . . . . 25.0 115.896 -169.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.74 26.37 69.6 Favored Glycine 0 C--O 1.221 -0.673 0 N-CA-C 116.436 1.335 . . . . 25.0 116.436 170.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.64 161.97 17.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.083 0.942 . . . . 25.0 111.311 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -138.83 171.35 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 106.583 -1.636 . . . . 25.0 106.583 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -101.69 137.5 39.92 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.921 0.782 . . . . 25.0 110.007 177.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.9 t -116.82 108.17 15.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 122.129 0.966 . . . . 25.0 111.076 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -65.41 -24.28 67.16 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 113.112 0.782 . . . . 25.0 113.112 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -66.61 -40.32 88.76 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.137 -0.352 . . . . 25.0 111.07 -176.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 p -103.89 -7.83 20.16 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.595 -0.442 . . . . 25.0 111.8 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm 62.56 35.45 14.45 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.659 0.783 . . . . 25.0 110.266 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.54 160.75 28.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.49 0.662 . . . . 25.0 110.635 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 43.8 t -86.27 128.2 34.88 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.122 -3.288 . . . . 25.0 102.122 168.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.7 p -126.92 163.97 22.48 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 122.581 0.352 . . . . 25.0 111.363 -172.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -65.44 146.84 54.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.895 0.379 . . . . 25.0 111.636 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -64.17 -28.99 70.13 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 112.863 0.69 . . . . 25.0 112.863 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 91.36 -3.21 79.23 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 115.206 0.842 . . . . 25.0 115.206 175.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.49 121.16 14.26 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.735 0.768 . . . . 25.0 111.938 178.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.16 125.18 28.42 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 106.316 -1.735 . . . . 25.0 106.316 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -85.4 -7.65 8.8 Favored 'Trans proline' 0 C--N 1.347 0.453 0 N-CA-C 116.284 1.609 . . . . 25.0 116.284 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 . . . . . 0 C--O 1.247 0.938 0 N-CA-C 109.579 -0.526 . . . . 25.0 109.579 -178.597 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.012 0 CA-C-O 119.206 -0.775 . . . . 25.0 111.62 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.2 t -152.05 156.26 33.91 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 104.384 -2.45 . . . . 25.0 104.384 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -60.95 143.67 99.4 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 116.569 -1.821 . . . . 25.0 113.377 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -67.29 -20.14 65.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.797 0.808 . . . . 25.0 109.806 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.71 -36.71 70.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.083 -0.962 . . . . 25.0 111.912 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.72 -0.99 21.42 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.853 0.686 . . . . 25.0 112.853 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -74.53 128.64 36.06 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 121.612 -0.68 . . . . 25.0 109.302 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 76.59 22.18 73.17 Favored Glycine 0 C--O 1.227 -0.288 0 C-N-CA 120.964 -0.636 . . . . 25.0 112.881 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -113.44 148.15 36.46 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.892 -0.781 . . . . 25.0 108.892 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.72 31.02 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.39 142.83 56.6 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.877 -0.786 . . . . 25.0 108.877 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.75 -174.22 22.76 Favored Glycine 0 C--O 1.229 -0.156 0 C-N-CA 121.21 -0.519 . . . . 25.0 113.122 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -96.67 148.83 22.47 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.593 0.357 . . . . 25.0 110.332 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -131.08 148.19 69.28 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-N 116.028 -0.533 . . . . 25.0 111.381 -176.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.12 147.45 60.6 Favored 'Trans proline' 0 C--N 1.351 0.708 0 N-CA-C 113.656 0.599 . . . . 25.0 113.656 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -121.89 150.81 56.77 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 114.965 -1.016 . . . . 25.0 111.259 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -86.12 -18.85 3.34 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 N-CA-C 117.712 2.158 . . . . 25.0 117.712 -174.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -117.16 -58.62 2.04 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 116.453 2.02 . . . . 25.0 116.453 -168.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.4 mp0 -68.3 150.17 48.55 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.202 0.525 . . . . 25.0 111.865 -173.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.16 -65.39 1.02 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-O 121.505 0.669 . . . . 25.0 111.555 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -95.32 24.56 4.96 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.565 0.95 . . . . 25.0 113.565 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.06 162.04 37.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.6 -177.85 6.63 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.298 -1.001 . . . . 25.0 108.298 -163.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -101.82 156.84 17.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.59 -1.633 . . . . 25.0 106.59 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.0 t -143.75 145.6 32.51 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 107.826 -1.176 . . . . 25.0 107.826 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 t -131.73 130.88 42.51 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.25 -1.019 . . . . 25.0 108.25 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.13 123.22 12.11 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.178 -1.045 . . . . 25.0 108.178 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.48 34.39 18.21 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.61 0.764 . . . . 25.0 112.444 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.59 13.35 82.03 Favored Glycine 0 C--O 1.237 0.342 0 C-N-CA 121.217 -0.516 . . . . 25.0 113.862 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -108.26 140.12 41.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.767 -1.198 . . . . 25.0 107.767 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 41.5 tp -87.77 128.65 35.32 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.315 0.384 . . . . 25.0 110.262 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -122.02 140.78 52.08 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 104.421 -2.437 . . . . 25.0 104.421 169.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -114.0 122.15 46.04 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 102.989 -2.967 . . . . 25.0 102.989 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -136.42 164.56 27.87 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 113.739 1.014 . . . . 25.0 113.739 -166.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.3 p -123.37 160.83 25.94 Favored 'General case' 0 C--N 1.32 -0.7 1 N-CA-C 100.191 -4.003 . . . . 25.0 100.191 164.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -101.55 123.5 44.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 106.021 -1.844 . . . . 25.0 106.021 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.43 -55.43 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 115.435 -2.576 . . . . 25.0 116.492 -170.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.58 85.0 6.6 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 115.389 1.625 . . . . 25.0 115.389 -174.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.53 -9.51 0.85 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 118.284 2.073 . . . . 25.0 118.284 168.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 31.6 mt -81.07 155.92 26.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 118.163 0.981 . . . . 25.0 113.11 -166.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.4 m -124.14 151.82 29.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 107.449 -1.315 . . . . 25.0 107.449 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -75.25 126.64 31.44 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.404 -0.81 . . . . 25.0 109.334 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.4 t -109.94 109.49 20.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.403 -0.962 . . . . 25.0 108.403 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.83 -14.01 60.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.723 1.008 . . . . 25.0 113.723 -176.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.5 p -71.48 -47.86 52.89 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.299 -0.876 . . . . 25.0 110.249 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.2 p -92.78 -6.66 48.48 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.772 1.027 . . . . 25.0 113.772 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 59.94 35.16 21.65 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.108 -1.441 . . . . 25.0 107.108 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -142.91 168.03 20.67 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.584 -0.734 . . . . 25.0 110.389 -172.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.73 131.27 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.101 -1.074 . . . . 25.0 108.101 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.86 152.96 43.32 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.699 0.285 . . . . 25.0 110.369 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.0 t90 -72.48 146.38 46.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 107.35 -1.352 . . . . 25.0 107.35 174.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -79.82 84.12 5.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.024 0.44 . . . . 25.0 111.392 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -91.65 32.91 5.05 Favored Glycine 0 C--O 1.227 -0.284 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.335 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 tp -74.45 106.74 6.2 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.081 0.467 . . . . 25.0 110.19 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.456 HG12 ' H ' ' A' ' 57' ' ' ARG . 58.7 t -79.24 121.91 83.58 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 107.319 -1.363 . . . . 25.0 107.319 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -84.97 7.9 4.93 Favored 'Trans proline' 0 C--N 1.349 0.58 0 N-CA-C 114.38 0.877 . . . . 25.0 114.38 -177.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.456 ' H ' HG12 ' A' ' 55' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.245 0.852 0 CA-C-O 117.298 -1.334 . . . . 25.0 110.889 -176.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.975 0 CA-C-O 119.733 -0.481 . . . . 25.0 112.249 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.8 t -65.67 139.11 96.92 Favored Pre-proline 0 N--CA 1.478 0.959 0 CA-C-N 117.273 0.537 . . . . 25.0 110.34 177.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.49 119.73 6.84 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 116.466 -1.889 . . . . 25.0 115.073 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p -76.63 -1.98 30.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.881 0.848 . . . . 25.0 109.985 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -56.27 -31.34 63.51 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.302 -0.863 . . . . 25.0 111.384 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.6 t -110.98 -16.28 13.56 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.475 0.917 . . . . 25.0 113.475 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.81 126.14 28.09 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 119.297 -0.961 . . . . 25.0 108.498 177.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 10.88 72.34 Favored Glycine 0 CA--C 1.521 0.454 0 CA-C-N 115.544 -0.753 . . . . 25.0 113.544 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -106.91 149.39 27.51 Favored 'General case' 0 CA--C 1.504 -0.813 0 O-C-N 121.448 -1.03 . . . . 25.0 108.392 178.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.48 151.43 41.05 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 105.83 -1.915 . . . . 25.0 105.83 176.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.78 150.36 49.23 Favored 'General case' 0 C--O 1.246 0.904 0 N-CA-C 107.578 -1.268 . . . . 25.0 107.578 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.0 179.59 19.13 Favored Glycine 0 C--O 1.242 0.612 0 N-CA-C 110.097 -1.201 . . . . 25.0 110.097 -175.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.2 mt -101.33 149.44 24.03 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 112.865 0.691 . . . . 25.0 112.865 -177.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -132.79 144.12 51.57 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 107.622 -1.251 . . . . 25.0 107.622 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.16 149.19 45.59 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 117.32 -1.32 . . . . 25.0 114.249 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -96.3 118.27 65.58 Favored Pre-proline 0 C--O 1.216 -0.702 0 N-CA-C 108.586 -0.894 . . . . 25.0 108.586 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -79.92 -13.18 13.04 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 115.415 1.275 . . . . 25.0 115.415 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -87.41 -42.73 12.62 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.151 0.501 . . . . 25.0 111.167 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -97.94 155.32 17.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.16 -0.927 . . . . 25.0 112.689 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -69.2 -46.85 66.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.521 1.674 . . . . 25.0 115.521 -177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -130.44 20.75 5.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.742 1.756 . . . . 25.0 115.742 -167.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 63.1 p -111.01 164.15 13.11 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -135.13 166.58 22.75 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 122.128 0.966 . . . . 25.0 108.591 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -97.6 145.78 25.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 101.209 -3.626 . . . . 25.0 101.209 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -135.76 138.44 42.66 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.4 m -114.13 123.95 50.88 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.825 -0.805 . . . . 25.0 108.825 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.98 113.62 13.62 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.81 38.54 26.88 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.913 0.758 . . . . 25.0 109.383 -177.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.36 15.2 74.85 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 115.565 0.986 . . . . 25.0 115.565 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -113.57 149.18 34.85 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -93.3 130.44 39.03 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 113.674 0.99 . . . . 25.0 113.674 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.97 137.83 53.23 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 169.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -117.65 108.98 16.09 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 105.332 -2.099 . . . . 25.0 105.332 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.73 165.4 27.39 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.188 -0.32 . . . . 25.0 110.786 -168.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 46.2 p -102.82 164.11 11.82 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.849 0.833 . . . . 25.0 111.623 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.18 95.8 38.2 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 104.5 -2.407 . . . . 25.0 104.5 167.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -91.83 -119.13 0.01 OUTLIER 'Trans proline' 0 C--O 1.25 1.12 0 C-N-CA 120.435 0.757 . . . . 25.0 113.211 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.49 142.61 58.36 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 121.115 -0.99 . . . . 25.0 112.185 -178.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 79.27 -7.6 51.67 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 116.947 1.539 . . . . 25.0 116.947 173.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.6 mt -131.83 142.69 49.79 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.146 0.973 . . . . 25.0 111.773 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.8 149.71 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -90.1 132.39 35.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.657 0.742 . . . . 25.0 112.631 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.8 t -113.32 102.64 10.54 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 121.726 0.774 . . . . 25.0 109.737 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -63.74 -27.75 69.41 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 114.385 1.254 . . . . 25.0 114.385 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 p -67.7 -35.67 79.23 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.053 0.39 . . . . 25.0 112.053 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.3 p -104.83 -7.82 19.16 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.079 0.4 . . . . 25.0 112.079 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm 59.43 44.76 14.57 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.087 1.355 . . . . 25.0 113.069 -174.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.02 168.08 16.56 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.02 -0.991 . . . . 25.0 110.998 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.23 132.3 53.22 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 103.119 -2.919 . . . . 25.0 103.119 168.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 77.1 p -118.69 158.5 25.39 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.76 0.791 . . . . 25.0 111.314 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -70.02 137.42 51.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.098 -0.955 . . . . 25.0 109.354 178.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -99.5 105.23 17.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.066 0.46 . . . . 25.0 111.836 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -172.1 -35.34 0.03 OUTLIER Glycine 0 C--O 1.209 -1.46 0 C-N-CA 120.912 -0.661 . . . . 25.0 114.117 -179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 126.14 30.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 118.0 0.9 . . . . 25.0 110.862 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.2 t -130.62 117.88 17.7 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 109.901 -0.407 . . . . 25.0 109.901 176.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -85.43 -3.45 9.33 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 121.58 1.52 . . . . 25.0 114.365 -176.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? . . . . . 0 CA--C 1.511 -0.541 0 N-CA-C 106.679 -1.6 . . . . 25.0 106.679 -178.8 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.036 0 CA-C-O 118.788 -1.007 . . . . 25.0 111.389 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.3 t -138.31 143.44 38.89 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 106.184 -1.784 . . . . 25.0 106.184 178.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.07 -14.26 18.95 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 117.521 -1.186 . . . . 25.0 114.043 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.6 p 48.03 26.23 0.95 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.136 1.161 . . . . 25.0 114.136 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -64.53 -45.42 87.23 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 113.959 1.096 . . . . 25.0 113.959 -173.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.34 -7.31 13.98 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.563 0.697 . . . . 25.0 111.979 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -70.85 122.51 20.05 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 116.154 -0.476 . . . . 25.0 109.83 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.32 19.95 68.01 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.173 -0.537 . . . . 25.0 113.041 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -119.48 149.86 41.19 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 117.171 0.486 . . . . 25.0 111.097 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 153.27 42.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.245 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 26' ' ' CYS . 72.6 m-20 -70.45 148.41 48.35 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.652 -0.704 . . . . 25.0 110.353 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.23 -179.41 23.26 Favored Glycine 0 CA--C 1.517 0.169 0 N-CA-C 109.942 -1.263 . . . . 25.0 109.942 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -98.75 143.93 28.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.286 1.043 . . . . 25.0 111.108 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.98 148.2 61.95 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.665 -0.495 . . . . 25.0 109.665 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.35 148.86 55.84 Favored 'Trans proline' 0 C--N 1.35 0.614 0 N-CA-C 115.249 1.211 . . . . 25.0 115.249 -175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -84.07 154.77 64.05 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-N 114.408 -1.269 . . . . 25.0 110.38 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -81.48 -21.15 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 N-CA-C 115.981 1.493 . . . . 25.0 115.981 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 -29.67 0.49 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.3 1.593 . . . . 25.0 115.3 -169.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -74.47 -178.51 3.56 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 124.482 1.113 . . . . 25.0 112.349 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -134.96 -56.05 0.82 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.498 -0.751 . . . . 25.0 111.549 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -79.87 -2.84 45.36 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.5 p -130.36 154.58 47.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.437 . . . . 25.0 110.529 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -177.93 6.07 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.279 -1.008 . . . . 25.0 108.279 -170.112 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -106.04 158.87 16.49 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 176.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.1 t -142.73 153.41 43.3 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.091 -1.448 . . . . 25.0 107.091 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.514 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -126.46 128.29 46.73 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 104.46 -2.422 . . . . 25.0 104.46 175.184 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.85 118.76 11.81 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.97 -1.493 . . . . 25.0 106.97 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.71 33.72 21.91 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.801 0.84 . . . . 25.0 110.352 -173.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.15 7.94 68.46 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 114.619 0.608 . . . . 25.0 114.619 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -101.46 153.26 19.86 Favored 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 121.863 -0.786 . . . . 25.0 108.98 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.98 128.8 33.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.144 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.33 149.52 52.34 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.264 -2.495 . . . . 25.0 104.264 169.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -113.97 146.18 40.49 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 103.125 -2.917 . . . . 25.0 103.125 171.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -129.16 164.7 22.81 Favored 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 109.144 -0.687 . . . . 25.0 109.144 -171.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.0 p -146.58 155.03 42.18 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 102.022 -3.325 . . . . 25.0 102.022 171.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -116.76 117.55 37.52 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 103.086 -2.931 . . . . 25.0 103.086 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.86 -87.6 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 117.528 -1.181 . . . . 25.0 114.676 -171.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.4 t -104.07 153.11 21.27 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.565 -0.709 . . . . 25.0 110.874 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -10.48 4.71 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 118.968 2.347 . . . . 25.0 118.968 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 51' ' ' TRP . 73.5 mt -129.31 144.77 51.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 118.09 0.945 . . . . 25.0 109.439 -176.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.9 m -135.47 147.19 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 109.508 -0.553 . . . . 25.0 109.508 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -77.55 130.34 36.81 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.392 -0.818 . . . . 25.0 109.662 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -126.49 122.73 36.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.49 0.662 . . . . 25.0 109.638 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -64.31 -21.72 66.7 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.4 p -67.67 -32.25 72.78 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.784 0.265 . . . . 25.0 111.467 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.9 t -94.11 -21.75 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.438 -0.578 . . . . 25.0 109.438 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.3 tptt 60.32 26.85 16.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.982 -1.008 . . . . 25.0 108.46 -171.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -143.26 171.69 13.76 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.286 -1.324 . . . . 25.0 107.663 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.3 t -88.25 127.06 35.45 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.433 -1.691 . . . . 25.0 106.433 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 41.8 p -112.67 161.52 16.76 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.409 -0.589 . . . . 25.0 109.409 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.406 ' HA ' HD23 ' A' ' 40' ' ' LEU . 21.6 t90 -67.38 146.71 53.77 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.34 -0.615 . . . . 25.0 109.34 177.158 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -78.37 70.31 4.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.3 0.572 . . . . 25.0 111.477 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.38 51.8 4.61 Favored Glycine 0 C--O 1.227 -0.343 0 CA-C-N 115.902 -0.59 . . . . 25.0 112.956 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tt -66.82 130.78 44.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.914 -0.402 . . . . 25.0 109.914 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.431 HG12 ' H ' ' A' ' 57' ' ' ARG . 60.3 t -116.69 131.8 23.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 105.901 -1.888 . . . . 25.0 105.901 178.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -85.94 14.61 2.41 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 121.143 1.229 . . . . 25.0 113.647 -177.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.431 ' H ' HG12 ' A' ' 55' ' ' VAL . 76.2 mtp85 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.214 -0.898 . . . . 25.0 109.468 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.995 0 CA-C-O 118.879 -0.956 . . . . 25.0 111.392 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.6 t -65.96 144.54 98.85 Favored Pre-proline 0 N--CA 1.469 0.507 0 CA-C-N 118.34 1.07 . . . . 25.0 108.943 177.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.06 -25.26 27.4 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 116.378 -1.948 . . . . 25.0 114.012 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.9 p -85.49 -2.93 58.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.263 0.554 . . . . 25.0 111.447 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -58.35 -39.48 79.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.092 0.775 . . . . 25.0 113.092 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.06 2.34 16.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.916 0.71 . . . . 25.0 112.916 -177.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -69.66 123.9 22.58 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.452 -0.573 . . . . 25.0 109.452 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.65 17.93 78.35 Favored Glycine 0 C--O 1.226 -0.37 0 C-N-CA 121.216 -0.516 . . . . 25.0 113.706 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -102.23 145.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-N 117.66 0.73 . . . . 25.0 109.995 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 152.35 44.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.857 -1.065 . . . . 25.0 108.868 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.66 160.39 22.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.667 -0.697 . . . . 25.0 111.899 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.11 -176.55 16.21 Favored Glycine 0 N--CA 1.458 0.143 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.966 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -96.33 151.88 19.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.48 0.657 . . . . 25.0 111.539 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -132.64 147.31 65.04 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 106.094 -1.817 . . . . 25.0 106.094 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.61 146.38 49.09 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 117.368 -1.288 . . . . 25.0 113.528 -175.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -107.59 124.19 35.75 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 116.43 -0.35 . . . . 25.0 110.147 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.71 -15.96 8.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 116.234 1.59 . . . . 25.0 116.234 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -123.24 -47.03 2.03 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 119.554 3.168 . . . . 25.0 119.554 -170.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.36 -65.76 0.51 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 116.273 1.953 . . . . 25.0 116.273 -164.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -172.47 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.985 -0.746 . . . . 25.0 108.985 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.3 p -118.36 14.98 13.88 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.286 -1.746 . . . . 25.0 106.286 175.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 114.251 -1.34 . . . . 25.0 110.374 -178.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -133.32 -179.46 5.52 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.978 -1.119 . . . . 25.0 107.978 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -107.86 145.17 34.05 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.621 -3.103 . . . . 25.0 102.621 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -134.33 143.14 47.51 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 106.609 -1.626 . . . . 25.0 106.609 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.91 127.7 52.1 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 177.498 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.17 120.59 14.98 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.72 32.25 17.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.645 0.778 . . . . 25.0 111.855 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.2 79.77 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 121.119 -0.562 . . . . 25.0 113.669 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -118.62 148.36 42.79 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.678 -1.23 . . . . 25.0 107.678 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 51.4 tp -91.41 129.17 37.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.53 0.566 . . . . 25.0 112.53 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -120.72 132.56 55.14 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.429 -1.693 . . . . 25.0 106.429 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -113.98 107.34 15.54 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 104.309 -2.478 . . . . 25.0 104.309 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -143.51 169.62 17.36 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.788 -0.449 . . . . 25.0 109.788 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.6 p -117.42 160.07 21.77 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.274 -0.639 . . . . 25.0 109.274 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.53 127.68 55.7 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 107.371 -1.344 . . . . 25.0 107.371 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.83 -55.68 0.25 Allowed 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 116.091 -2.139 . . . . 25.0 117.028 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -106.31 143.75 33.99 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.709 -0.619 . . . . 25.0 112.275 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.08 14.39 70.93 Favored Glycine 0 C--O 1.222 -0.597 0 N-CA-C 115.909 1.124 . . . . 25.0 115.909 169.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.3 111.6 0.6 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 118.945 2.943 . . . . 25.0 118.945 -160.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.3 m -145.62 161.49 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 N-CA-C 104.569 -2.382 . . . . 25.0 104.569 165.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -116.05 130.03 56.63 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.678 -0.49 . . . . 25.0 109.678 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.2 t -110.17 114.22 27.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.843 0.83 . . . . 25.0 109.812 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -63.01 -31.35 72.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.386 -0.824 . . . . 25.0 113.118 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 44.4 p -65.57 -32.07 73.46 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 28.3 p -104.51 -5.38 21.62 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.39 -0.226 . . . . 25.0 110.39 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? 52.3 41.25 30.37 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 -173.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.4 p -143.15 168.37 19.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.613 -0.722 . . . . 25.0 111.417 -172.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.3 t -86.21 139.93 30.61 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.061 -1.459 . . . . 25.0 107.061 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.9 p -128.02 167.84 16.14 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 105.497 -2.038 . . . . 25.0 105.497 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.7 148.66 31.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.243 -1.762 . . . . 25.0 106.243 174.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -63.23 140.53 58.88 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.174 -0.676 . . . . 25.0 109.174 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.02 -6.16 68.16 Favored Glycine 0 CA--C 1.52 0.36 0 N-CA-C 115.363 0.905 . . . . 25.0 115.363 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.64 159.0 15.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 118.049 0.924 . . . . 25.0 112.885 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 57' ' ' ARG . 40.8 t -85.92 136.58 36.27 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 106.356 -1.72 . . . . 25.0 106.356 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -79.26 4.14 6.84 Favored 'Trans proline' 0 C--N 1.351 0.677 0 N-CA-C 114.62 0.969 . . . . 25.0 114.62 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.435 ' H ' HG12 ' A' ' 55' ' ' VAL . 27.5 mtp180 . . . . . 0 C--O 1.241 0.616 0 C-N-CA 123.573 0.749 . . . . 25.0 108.981 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 CA-C-O 119.102 -0.832 . . . . 25.0 111.469 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -64.26 131.27 94.98 Favored Pre-proline 0 N--CA 1.467 0.378 0 CA-C-N 118.183 0.991 . . . . 25.0 111.155 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -74.76 -28.2 9.83 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 116.39 -1.94 . . . . 25.0 113.637 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.4 p -75.83 -21.01 57.72 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 121.228 0.537 . . . . 25.0 112.055 -175.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.558 ' CD1' HD13 ' A' ' 31' ' ' LEU . 77.1 t80 -64.91 -28.85 69.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.353 -0.385 . . . . 25.0 111.913 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -111.31 10.11 21.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.625 -0.262 . . . . 25.0 111.529 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -73.69 138.8 44.93 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 71.65 17.58 76.65 Favored Glycine 0 C--O 1.227 -0.31 0 C-N-CA 121.027 -0.606 . . . . 25.0 112.733 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -126.33 147.72 49.68 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.125 -0.695 . . . . 25.0 109.125 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.17 156.56 35.76 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -69.94 148.07 49.41 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.744 -1.206 . . . . 25.0 107.744 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.04 -174.39 24.41 Favored Glycine 0 N--CA 1.454 -0.124 0 N-CA-C 110.243 -1.143 . . . . 25.0 110.243 -175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.2 mt -97.64 148.85 22.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.427 0.614 . . . . 25.0 111.347 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -132.13 154.51 81.69 Favored Pre-proline 0 C--O 1.24 0.568 0 N-CA-C 112.111 0.412 . . . . 25.0 112.111 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.413 ' HB3' HD21 ' A' ' 44' ' ' ASN . 59.4 Cg_endo -65.07 131.1 27.55 Favored 'Trans proline' 0 C--N 1.357 0.984 0 N-CA-C 114.346 0.864 . . . . 25.0 114.346 -177.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -118.8 150.69 48.92 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.562 -172.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.65 -19.44 4.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 N-CA-C 117.3 2.0 . . . . 25.0 117.3 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -79.49 -59.85 2.59 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 116.235 1.939 . . . . 25.0 116.235 -166.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.91 151.24 40.8 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.252 0.464 . . . . 25.0 112.252 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -60.45 -33.2 72.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.766 0.826 . . . . 25.0 111.142 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 p -85.69 -0.34 54.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.769 -1.105 . . . . 25.0 113.684 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 91.2 p -122.46 167.54 13.21 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 -178.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -154.83 173.89 15.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.409 0.623 . . . . 25.0 111.764 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -102.83 145.29 29.99 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 102.343 -3.206 . . . . 25.0 102.343 169.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.2 t -135.72 141.62 44.92 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.2 m -117.11 127.54 54.24 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 105.732 -1.951 . . . . 25.0 105.732 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.68 128.52 23.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.835 -1.913 . . . . 25.0 105.835 177.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.29 28.54 13.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.986 0.914 . . . . 25.0 110.578 -173.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 69.17 23.37 76.23 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 121.202 -0.523 . . . . 25.0 113.799 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.1 mmt-85 -123.82 149.37 45.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 117.855 0.827 . . . . 25.0 109.013 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.558 HD13 ' CD1' ' A' ' 5' ' ' PHE . 51.2 tp -79.42 127.9 32.68 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 114.046 1.128 . . . . 25.0 114.046 -177.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -123.86 131.96 53.67 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 167.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -113.98 124.31 51.85 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.202 -1.777 . . . . 25.0 106.202 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -143.49 170.94 14.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.024 -0.361 . . . . 25.0 110.024 -172.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 69.8 p -121.31 162.79 19.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 176.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.5 t -123.14 71.53 44.4 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 106.474 -1.676 . . . . 25.0 106.474 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.27 -27.71 9.36 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 116.201 -2.066 . . . . 25.0 117.277 -164.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.07 86.41 5.53 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.505 1.298 . . . . 25.0 114.505 -175.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.98 2.14 29.31 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.312 2.085 . . . . 25.0 118.312 168.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.0 mt -122.69 162.87 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.215 1.007 . . . . 25.0 111.158 -173.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.31 159.82 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.457 -0.338 . . . . 25.0 110.66 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.78 125.89 29.15 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.258 -0.577 . . . . 25.0 110.351 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -107.2 109.72 21.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.862 0.839 . . . . 25.0 109.226 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.413 HD21 ' HB3' ' A' ' 15' ' ' PRO . 0.7 OUTLIER -66.29 -20.55 66.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.11 1.152 . . . . 25.0 114.11 -176.101 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.6 p -70.75 -43.65 68.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.545 0.572 . . . . 25.0 112.545 -177.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 13.9 p -104.5 -6.96 20.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.93 0.344 . . . . 25.0 111.93 -177.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 61.66 39.32 14.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.857 0.863 . . . . 25.0 110.928 -176.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.96 169.14 13.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.577 -0.738 . . . . 25.0 109.505 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.5 t -99.16 122.89 42.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -146.24 173.67 12.02 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.062 0.145 . . . . 25.0 110.676 -173.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -57.17 148.71 21.42 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.94 0.4 . . . . 25.0 111.569 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.61 61.92 3.74 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.628 0.973 . . . . 25.0 113.628 -177.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.2 43.49 79.97 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 115.752 1.061 . . . . 25.0 115.752 173.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.4 tt -66.55 128.55 36.66 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.144 -0.687 . . . . 25.0 109.144 177.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.463 HG12 ' H ' ' A' ' 57' ' ' ARG . 55.5 t -119.54 131.85 24.23 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 106.436 -1.69 . . . . 25.0 106.436 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -83.03 5.74 6.24 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 N-CA-C 114.784 1.032 . . . . 25.0 114.784 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.463 ' H ' HG12 ' A' ' 55' ' ' VAL . 4.2 mmp_? . . . . . 0 C--O 1.242 0.669 0 N-CA-C 106.636 -1.616 . . . . 25.0 106.636 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.963 0 CA-C-O 118.717 -1.046 . . . . 25.0 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.1 t 66.26 151.69 0.12 Allowed Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -60.69 -25.05 80.19 Favored 'Trans proline' 0 C--O 1.204 -1.186 0 C-N-CA 116.192 -2.072 . . . . 25.0 116.794 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.03 -2.32 0.31 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 114.234 1.198 . . . . 25.0 114.234 -174.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.27 -37.32 86.82 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 125.02 1.328 . . . . 25.0 114.008 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -104.34 -1.98 26.16 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 118.437 0.562 . . . . 25.0 111.429 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -74.73 127.17 32.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.645 1.212 . . . . 25.0 108.661 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.9 -8.35 70.26 Favored Glycine 0 CA--C 1.546 2.006 0 CA-C-N 113.959 -1.473 . . . . 25.0 113.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -88.44 146.51 25.18 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 122.107 -0.643 . . . . 25.0 110.842 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.97 154.73 35.63 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.074 -1.084 . . . . 25.0 108.074 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -63.5 148.11 49.56 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 109.906 -0.405 . . . . 25.0 109.906 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.36 -169.64 25.37 Favored Glycine 0 C--O 1.211 -1.3 0 N-CA-C 110.485 -1.046 . . . . 25.0 110.485 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.5 mt -115.37 138.19 51.25 Favored 'General case' 0 CA--C 1.488 -1.44 0 O-C-N 120.502 -1.587 . . . . 25.0 110.835 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -124.99 146.45 53.55 Favored Pre-proline 0 C--O 1.218 -0.567 0 C-N-CA 125.198 1.399 . . . . 25.0 108.317 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 151.21 40.96 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 115.998 -2.201 . . . . 25.0 113.901 -171.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -87.37 138.07 32.28 Favored Pre-proline 0 CA--C 1.556 1.21 0 N-CA-C 109.1 -0.704 . . . . 25.0 109.1 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -79.41 -19.79 10.04 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 N-CA-C 116.107 1.541 . . . . 25.0 116.107 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -102.14 -42.38 6.08 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.941 -0.474 . . . . 25.0 111.816 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -106.44 162.16 13.95 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.9 -0.778 . . . . 25.0 108.9 173.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.52 -8.05 10.53 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 116.484 2.031 . . . . 25.0 116.484 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.23 10.36 31.83 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 107.849 -1.167 . . . . 25.0 107.849 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 79.7 p -121.75 167.31 13.12 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 107.867 -1.16 . . . . 25.0 107.867 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -146.72 169.95 17.98 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.099 -0.955 . . . . 25.0 109.657 -175.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.23 133.86 42.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 104.302 -2.481 . . . . 25.0 104.302 164.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -112.71 135.69 53.16 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.21 -2.145 . . . . 25.0 105.21 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -116.09 125.04 51.85 Favored 'General case' 0 C--O 1.246 0.873 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 174.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.7 124.86 16.37 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 124.243 0.965 . . . . 25.0 108.988 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 51.63 37.1 19.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.021 0.915 . . . . 25.0 111.186 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.37 7.73 64.58 Favored Glycine 0 CA--C 1.543 1.823 0 CA-C-N 115.12 -0.946 . . . . 25.0 115.156 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -108.56 150.67 27.16 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 120.805 -1.409 . . . . 25.0 108.325 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.89 133.88 36.84 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -124.76 149.23 47.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 105.715 -1.957 . . . . 25.0 105.715 171.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -129.13 105.95 8.52 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.803 -1.185 . . . . 25.0 108.09 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.97 175.23 9.73 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 112.743 0.645 . . . . 25.0 112.743 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 72.7 p -113.08 163.31 14.88 Favored 'General case' 0 C--O 1.206 -1.191 0 O-C-N 123.682 0.614 . . . . 25.0 111.708 177.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.2 88.69 37.96 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 102.136 -3.283 . . . . 25.0 102.136 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -85.09 -66.27 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.139 0 N-CA-C 120.638 3.284 . . . . 25.0 120.638 -167.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.54 117.81 25.55 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.045 -1.659 . . . . 25.0 112.703 -170.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.24 17.91 79.66 Favored Glycine 0 CA--C 1.55 2.273 0 CA-C-O 117.658 -1.634 . . . . 25.0 113.271 174.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 71.1 mt -138.13 153.19 49.26 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 114.785 1.402 . . . . 25.0 114.785 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.82 166.96 18.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -101.4 129.7 47.47 Favored 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.762 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.6 t -119.92 112.01 18.66 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 123.222 1.487 . . . . 25.0 109.895 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.02 -23.88 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.935 -1.029 . . . . 25.0 112.455 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.2 p -68.52 -29.89 68.58 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 118.964 -0.541 . . . . 25.0 111.583 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.37 -6.72 22.71 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.5 tptt 59.29 33.65 22.63 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 123.124 1.44 . . . . 25.0 108.963 -177.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 2.6 p -145.89 167.49 23.14 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 113.647 -1.615 . . . . 25.0 113.935 -170.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.1 t -85.79 136.31 33.37 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 115.15 -0.932 . . . . 25.0 109.377 175.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.9 p -131.39 170.64 14.38 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.355 -0.98 . . . . 25.0 108.355 -175.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -76.29 140.15 41.4 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.129 0.972 . . . . 25.0 112.423 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.76 -50.29 71.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.952 0.882 . . . . 25.0 111.702 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 155.66 -122.23 1.18 Allowed Glycine 0 C--O 1.242 0.624 0 CA-C-O 121.904 0.724 . . . . 25.0 113.265 -174.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.98 161.05 14.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.926 -0.749 . . . . 25.0 111.814 -176.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.1 t -109.74 126.39 29.2 Favored Pre-proline 0 N--CA 1.48 1.068 0 N-CA-C 104.226 -2.509 . . . . 25.0 104.226 176.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -82.15 -11.08 11.12 Favored 'Trans proline' 0 C--O 1.209 -0.95 0 N-CA-C 116.709 1.773 . . . . 25.0 116.709 -173.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 . . . . . 0 CA--C 1.499 -0.988 0 N-CA-C 105.165 -2.161 . . . . 25.0 105.165 -175.49 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 p . . . . . 0 C--O 1.222 -0.369 0 N-CA-C 112.632 0.604 . . . . 25.0 112.632 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -54.5 -37.61 65.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.054 1.501 . . . . 25.0 115.054 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.44 3.88 15.1 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.939 0.4 . . . . 25.0 112.05 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.56 122.09 19.88 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.631 -0.668 . . . . 25.0 109.812 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.64 -1.45 82.84 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 121.078 -0.582 . . . . 25.0 113.643 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -82.52 143.9 30.77 Favored 'General case' 0 CA--C 1.508 -0.664 0 O-C-N 122.275 -0.544 . . . . 25.0 111.61 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.76 158.47 32.32 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 171.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -67.23 175.3 2.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.881 -0.599 . . . . 25.0 111.404 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.15 -178.86 19.32 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 110.73 -0.948 . . . . 25.0 110.73 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.424 HD22 ' CD2' ' A' ' 23' ' ' PHE . 45.9 mt -100.88 149.28 24.03 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.135 0.493 . . . . 25.0 112.192 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -130.07 151.68 78.76 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.378 0.671 . . . . 25.0 109.676 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.31 146.47 63.12 Favored 'Trans proline' 0 C--N 1.352 0.752 0 N-CA-C 115.11 1.158 . . . . 25.0 115.11 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -90.77 155.87 45.18 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 114.655 -1.157 . . . . 25.0 110.71 -176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -89.87 -17.94 1.58 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 N-CA-C 117.743 2.17 . . . . 25.0 117.743 -173.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -137.0 -50.42 0.65 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 117.3 2.333 . . . . 25.0 117.3 -168.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -74.41 164.08 27.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -171.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -65.76 -44.34 86.16 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 115.357 1.614 . . . . 25.0 115.357 -176.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 m -143.43 35.29 1.32 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.046 1.499 . . . . 25.0 115.046 -174.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 89.7 p -98.05 171.31 8.33 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 34' ' ' GLN . 14.5 p90 -147.48 172.66 13.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.471 0.653 . . . . 25.0 109.719 178.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -105.95 148.42 27.67 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 103.761 -2.681 . . . . 25.0 103.761 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -134.16 139.99 46.25 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.874 -1.899 . . . . 25.0 105.874 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -116.15 129.57 56.38 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.48 -0.933 . . . . 25.0 108.48 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.97 114.54 9.82 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.813 -1.18 . . . . 25.0 107.813 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.25 38.52 27.86 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.212 0.605 . . . . 25.0 112.168 -178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.63 1.91 73.41 Favored Glycine 0 N--CA 1.465 0.593 0 N-CA-C 115.316 0.886 . . . . 25.0 115.316 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -98.52 148.02 24.18 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.1 tp -100.98 132.81 46.22 Favored 'General case' 0 C--O 1.218 -0.576 0 O-C-N 123.799 0.687 . . . . 25.0 111.539 -176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -119.67 142.73 48.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.688 -1.597 . . . . 25.0 106.688 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -122.45 115.76 22.79 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.056 -2.201 . . . . 25.0 105.056 174.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.437 ' HB2' ' CE2' ' A' ' 23' ' ' PHE . 78.2 mt-30 -139.79 171.04 14.79 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.646 -0.502 . . . . 25.0 109.646 -171.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 59.9 p -110.66 155.72 22.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.41 0.893 . . . . 25.0 113.41 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.19 89.94 22.38 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 105.292 -2.114 . . . . 25.0 105.292 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.49 -52.33 0.05 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 0 N-CA-C 118.846 2.595 . . . . 25.0 118.846 -166.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 m -104.24 106.68 17.26 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.32 1.6 . . . . 25.0 115.32 -170.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.88 -4.89 14.34 Favored Glycine 0 N--CA 1.467 0.703 0 N-CA-C 114.318 0.487 . . . . 25.0 114.318 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.26 136.47 34.52 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.226 0.61 . . . . 25.0 110.868 -175.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.7 m -131.5 149.6 33.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 108.528 -0.916 . . . . 25.0 108.528 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -80.49 138.64 36.58 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.652 -0.499 . . . . 25.0 109.652 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -119.37 113.44 20.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.976 0.893 . . . . 25.0 110.086 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.8 -19.91 65.38 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.154 0.798 . . . . 25.0 113.154 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.2 p -75.18 -36.02 61.5 Favored 'General case' 0 C--O 1.219 -0.533 0 O-C-N 122.005 -0.435 . . . . 25.0 111.722 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.1 p -102.07 -7.78 21.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.635 0.976 . . . . 25.0 113.635 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 mptt 57.82 36.9 26.84 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 106.995 -1.483 . . . . 25.0 106.995 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.3 p -140.9 166.49 24.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 25.0 108.872 -174.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.1 t -113.98 137.27 51.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.333 -2.099 . . . . 25.0 105.333 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.1 t -141.0 160.23 40.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.136 0.493 . . . . 25.0 109.737 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 . . . . . 0 C--N 1.321 -0.638 0 N-CA-C 107.949 -1.13 . . . . 25.0 107.949 177.472 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.362 0 N-CA-C 116.372 1.989 . . . . 25.0 116.372 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.85 -33.6 72.01 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.781 0.66 . . . . 25.0 112.781 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -109.61 8.04 24.79 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.165 0.507 . . . . 25.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -78.14 126.85 31.41 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 121.248 -0.908 . . . . 25.0 108.731 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 21.12 80.05 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.455 -0.878 . . . . 25.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -118.48 146.79 44.23 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 150.94 46.52 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 106.988 -1.486 . . . . 25.0 106.988 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.95 148.45 46.0 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 174.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -168.25 25.54 Favored Glycine 0 C--N 1.316 -0.578 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.0 mt -105.76 147.17 28.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.218 0.509 . . . . 25.0 110.86 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -129.49 150.8 76.64 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.164 -0.471 . . . . 25.0 109.773 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.9 141.61 37.32 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 117.758 -1.028 . . . . 25.0 114.206 -178.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HA ' ' CE2' ' A' ' 24' ' ' TYR . 26.7 t-20 -92.04 133.32 30.58 Favored Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 104.34 -2.467 . . . . 25.0 104.34 172.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -73.5 -19.0 22.3 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 115.247 1.21 . . . . 25.0 115.247 -175.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -97.94 -35.86 10.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.306 0.574 . . . . 25.0 111.685 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.09 158.89 17.8 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 113.38 0.882 . . . . 25.0 113.38 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -100.68 -42.38 6.54 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 112.489 0.552 . . . . 25.0 112.489 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.0 m -113.27 -25.6 8.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 10.4 m -78.17 151.08 33.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.549 -0.908 . . . . 25.0 108.549 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -141.25 172.84 12.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.424 0.631 . . . . 25.0 111.756 -171.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' A' ' 16' ' ' ASN . 59.9 m-85 -100.38 151.79 21.11 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.18 -2.526 . . . . 25.0 104.18 170.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.0 t -142.7 145.7 33.64 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 108.781 -0.822 . . . . 25.0 108.781 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.3 m -126.43 136.22 52.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.01 -1.478 . . . . 25.0 107.01 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.72 117.96 7.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.693 -1.225 . . . . 25.0 107.693 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.07 34.59 20.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.064 0.946 . . . . 25.0 110.384 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.34 2.95 69.13 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 115.975 -0.557 . . . . 25.0 113.507 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -90.38 144.89 25.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.026 -1.472 . . . . 25.0 107.026 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.38 133.77 34.78 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 123.245 0.34 . . . . 25.0 110.567 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.81 139.89 52.77 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 106.634 -1.617 . . . . 25.0 106.634 169.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -123.6 115.82 22.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.601 -2.74 . . . . 25.0 103.601 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.93 165.72 26.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 25.0 110.817 -169.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 65.7 p -109.34 154.76 22.07 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.466 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -116.13 98.3 51.04 Favored Pre-proline 0 C--N 1.317 -0.83 0 N-CA-C 103.981 -2.6 . . . . 25.0 103.981 171.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.39 -92.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.311 0 N-CA-C 117.666 2.141 . . . . 25.0 117.666 -164.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.45 114.91 11.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.09 -1.631 . . . . 25.0 114.448 -167.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.31 8.75 85.73 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 115.558 0.983 . . . . 25.0 115.558 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.1 mt -122.12 154.71 37.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.146 0.498 . . . . 25.0 112.101 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.4 m -139.0 160.6 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 107.483 -1.303 . . . . 25.0 107.483 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -87.79 142.83 27.51 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.693 -0.803 . . . . 25.0 108.919 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.3 t -126.02 107.31 10.31 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.539 0.685 . . . . 25.0 110.472 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -65.33 -25.09 67.46 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.516 -0.766 . . . . 25.0 112.618 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -65.07 -29.99 70.91 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.498 0.555 . . . . 25.0 112.498 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.92 -2.09 18.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.565 0.166 . . . . 25.0 111.445 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 54.14 37.55 27.32 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.47 -0.567 . . . . 25.0 109.47 -172.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.65 167.9 21.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 25.0 109.971 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.0 t -97.4 140.3 32.07 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.418 -1.697 . . . . 25.0 106.418 175.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 80.6 p -137.89 168.44 19.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.508 0.67 . . . . 25.0 111.781 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.8 m95 . . . . . 0 C--N 1.317 -0.839 0 N-CA-C 106.604 -1.628 . . . . 25.0 106.604 168.753 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.217 -0.61 0 CA-C-O 121.355 0.597 . . . . 25.0 110.795 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -55.69 -37.07 67.86 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.747 0.819 . . . . 25.0 112.748 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.0 t -107.18 -9.76 16.04 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.464 0.65 . . . . 25.0 112.063 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -73.33 128.16 34.7 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.203 -0.936 . . . . 25.0 109.066 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.52 6.2 89.36 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.827 -0.701 . . . . 25.0 112.602 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -94.92 145.71 24.73 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.115 -0.698 . . . . 25.0 109.115 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.91 148.19 44.58 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.937 -2.246 . . . . 25.0 104.937 172.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -66.59 146.19 54.77 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 176.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.59 -177.96 22.8 Favored Glycine 0 C--O 1.238 0.349 0 N-CA-C 110.383 -1.087 . . . . 25.0 110.383 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.9 mt -100.71 139.92 35.71 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.184 0.809 . . . . 25.0 113.184 -177.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -124.97 146.31 53.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 108.103 -1.073 . . . . 25.0 108.103 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.81 150.57 62.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 N-CA-C 114.336 0.86 . . . . 25.0 114.336 -175.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -98.98 132.81 22.91 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.208 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.45 -19.3 10.33 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.373 1.259 . . . . 25.0 115.373 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -88.53 -39.17 14.36 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -118.82 148.85 42.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.555 0.693 . . . . 25.0 112.611 -173.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -58.34 6.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.144 -0.934 . . . . 25.0 113.014 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.1 m -98.06 12.05 35.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 115.718 1.747 . . . . 25.0 115.718 -172.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 9.9 p -103.98 164.95 11.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.329 -0.548 . . . . 25.0 110.152 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -146.07 173.66 11.99 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.793 0.806 . . . . 25.0 109.853 -177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -107.9 140.44 41.02 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 103.333 -2.839 . . . . 25.0 103.333 170.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.9 t -126.24 122.39 35.4 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.817 -1.179 . . . . 25.0 107.817 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.1 m -97.87 127.7 43.99 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.345 -2.094 . . . . 25.0 105.345 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.38 115.04 7.7 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.498 -1.297 . . . . 25.0 107.498 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.96 34.52 22.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.784 0.834 . . . . 25.0 111.479 -176.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.45 13.23 80.11 Favored Glycine 0 C--O 1.239 0.437 0 C-N-CA 120.986 -0.626 . . . . 25.0 114.069 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 mmt-85 -106.71 146.38 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.45 109.99 22.07 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.226 0.329 . . . . 25.0 111.08 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -101.53 135.44 43.04 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.964 -1.495 . . . . 25.0 106.964 173.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -113.87 109.46 18.56 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 105.437 -2.061 . . . . 25.0 105.437 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -141.84 -179.44 6.2 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.884 -0.784 . . . . 25.0 108.884 -169.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 88.4 p -136.94 164.67 27.78 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.949 0.722 . . . . 25.0 112.949 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.32 80.94 37.44 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 175.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -82.53 -74.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.03 0 N-CA-C 117.123 1.932 . . . . 25.0 117.123 -173.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 115.29 16.99 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 114.004 1.112 . . . . 25.0 114.004 -172.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.56 11.62 80.29 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.871 -0.68 . . . . 25.0 114.576 173.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.3 mt -133.36 154.73 50.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.202 0.501 . . . . 25.0 110.469 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.7 m -141.46 157.69 21.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 107.96 -1.126 . . . . 25.0 107.96 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -93.79 126.4 38.95 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.728 -0.607 . . . . 25.0 109.799 177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.1 t -106.75 96.3 6.35 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.584 -0.895 . . . . 25.0 108.584 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -60.94 -27.82 68.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 25.0 111.533 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -31.17 72.27 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.03 0.752 . . . . 25.0 113.03 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 2.3 p -103.21 -8.83 20.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.715 0.293 . . . . 25.0 110.879 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 tptt 64.8 23.07 12.64 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.911 0.885 . . . . 25.0 111.481 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.13 169.17 16.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.113 -0.949 . . . . 25.0 111.409 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.2 t -93.35 139.39 30.72 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.911 -1.885 . . . . 25.0 105.911 173.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.3 p -128.4 161.46 29.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.071 0.463 . . . . 25.0 110.537 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.4 t90 . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 25.0 111.919 -178.903 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.3 p . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.648 0.737 . . . . 25.0 111.037 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -47.76 -52.92 16.88 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.21 -1.93 15.94 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.834 0.679 . . . . 25.0 112.834 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -66.75 138.59 57.49 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 120.783 -1.198 . . . . 25.0 109.067 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.03 4.01 90.39 Favored Glycine 0 C--O 1.247 0.919 0 C-N-CA 121.093 -0.575 . . . . 25.0 113.181 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -113.92 154.94 26.69 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 106.075 -1.824 . . . . 25.0 106.075 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.75 151.7 46.94 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.205 -0.665 . . . . 25.0 109.205 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.49 131.68 48.91 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 158.92 -177.42 35.51 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 110.724 -0.95 . . . . 25.0 110.724 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.6 mt -97.32 147.82 23.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.34 . . . . 25.0 110.571 -178.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -134.21 146.65 60.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 109.082 -0.71 . . . . 25.0 109.082 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -71.35 149.44 56.84 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 117.908 -0.928 . . . . 25.0 114.32 -172.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -95.74 129.63 33.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 106.388 -1.708 . . . . 25.0 106.388 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -80.84 -16.71 10.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 N-CA-C 114.884 1.071 . . . . 25.0 114.884 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -92.53 -39.08 11.57 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.727 0.411 . . . . 25.0 111.219 -176.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -110.54 171.7 7.3 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.717 0.77 . . . . 25.0 109.957 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -109.63 -36.48 5.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.655 -0.702 . . . . 25.0 112.81 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 t -86.9 -26.09 24.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.743 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 55.6 p -89.39 158.77 17.63 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 121.367 -0.833 . . . . 25.0 110.698 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -139.26 169.54 17.58 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.538 0.685 . . . . 25.0 109.3 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -103.56 150.03 24.32 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 102.914 -2.995 . . . . 25.0 102.914 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.8 t -140.13 141.2 36.1 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t -117.05 122.51 44.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.16 120.26 12.87 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.79 34.91 24.36 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.8 0.809 . . . . 25.0 112.01 -177.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.91 3.56 84.49 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.956 -0.566 . . . . 25.0 114.478 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -102.05 138.8 38.53 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.046 -1.094 . . . . 25.0 108.046 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.58 119.22 26.6 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.983 -0.747 . . . . 25.0 108.983 178.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -109.58 143.66 38.97 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.32 -1.733 . . . . 25.0 106.32 172.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -128.66 116.79 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.203 -2.147 . . . . 25.0 105.203 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -145.3 169.07 18.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.252 0.478 . . . . 25.0 110.464 -172.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 60.6 p -107.6 157.81 17.75 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.998 0.519 . . . . 25.0 111.64 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.17 88.3 31.9 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 107.391 -1.337 . . . . 25.0 107.391 173.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.77 -78.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.29 0 N-CA-C 119.486 2.841 . . . . 25.0 119.486 -170.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.08 96.39 1.06 Allowed 'General case' 0 C--O 1.242 0.66 0 N-CA-C 116.534 2.05 . . . . 25.0 116.534 -166.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.81 13.21 83.29 Favored Glycine 0 C--O 1.22 -0.749 0 CA-C-N 114.978 -1.01 . . . . 25.0 112.568 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.6 mt -107.03 137.75 44.5 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.638 0.732 . . . . 25.0 112.697 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.3 m -133.09 147.87 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.417 -0.81 . . . . 25.0 110.241 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -90.88 134.7 34.26 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.132 0.491 . . . . 25.0 110.732 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.7 t -114.02 102.68 10.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.649 1.214 . . . . 25.0 109.705 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.38 -24.18 64.75 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.688 0.996 . . . . 25.0 113.688 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 p -64.93 -35.63 81.77 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 111.689 0.255 . . . . 25.0 111.689 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.3 p -110.91 -2.54 15.99 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 113.706 1.002 . . . . 25.0 113.706 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 61.85 33.38 17.68 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.716 0.807 . . . . 25.0 111.152 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -113.52 166.72 11.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.091 0.472 . . . . 25.0 109.758 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -114.68 129.44 56.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 102.97 -2.974 . . . . 25.0 102.97 165.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.9 p -124.51 157.68 34.73 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.727 -0.471 . . . . 25.0 109.727 -174.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 4.1 t90 . . . . . 0 N--CA 1.445 -0.698 0 N-CA-C 108.596 -0.89 . . . . 25.0 108.596 176.179 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 C--O 1.217 -0.618 0 CA-C-O 120.873 0.368 . . . . 25.0 111.956 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 31' ' ' LEU . 72.3 t80 -57.83 -31.08 66.29 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.082 1.142 . . . . 25.0 114.082 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 m -111.69 2.0 17.0 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.654 0.613 . . . . 25.0 112.654 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -78.95 134.14 36.85 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.878 -1.527 . . . . 25.0 106.878 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.62 4.29 89.14 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.767 -0.73 . . . . 25.0 112.008 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -113.32 148.96 34.65 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 176.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 150.79 43.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.048 -1.834 . . . . 25.0 106.048 173.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.06 150.02 48.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.796 -1.187 . . . . 25.0 107.796 176.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -171.44 24.3 Favored Glycine 0 C--O 1.237 0.294 0 N-CA-C 110.241 -1.143 . . . . 25.0 110.241 -176.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.414 HD22 ' CD2' ' A' ' 23' ' ' PHE . 29.7 mt -105.94 141.0 38.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.558 0.694 . . . . 25.0 112.464 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -124.4 150.3 63.93 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -67.75 147.4 75.35 Favored 'Trans proline' 0 C--N 1.35 0.625 0 N-CA-C 114.325 0.856 . . . . 25.0 114.325 -176.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -92.04 154.96 43.41 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 114.86 -1.064 . . . . 25.0 111.175 -177.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.0 -33.24 19.97 Favored 'Trans proline' 0 CA--C 1.545 1.049 0 N-CA-C 116.71 1.773 . . . . 25.0 116.71 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -162.3 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 113.698 0.999 . . . . 25.0 113.698 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 36.25 -105.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.718 1.377 . . . . 25.0 114.718 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 -61.86 0.12 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.088 0.471 . . . . 25.0 111.545 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.7 p -150.94 37.94 0.65 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.169 0.985 . . . . 25.0 110.243 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 78.0 p -98.8 168.91 9.83 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.478 -1.237 . . . . 25.0 109.662 -179.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.414 ' CD2' HD22 ' A' ' 13' ' ' LEU . 7.9 p90 -145.68 172.73 12.85 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.848 -0.797 . . . . 25.0 108.848 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -102.76 137.17 41.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 102.86 -3.015 . . . . 25.0 102.86 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.1 t -126.72 135.47 51.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.8 m -113.69 127.75 56.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.545 -1.65 . . . . 25.0 106.545 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.48 122.12 12.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.52 31.59 17.39 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 124.07 0.948 . . . . 25.0 110.969 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.37 11.83 79.86 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.864 -0.607 . . . . 25.0 114.231 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -108.9 151.1 26.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.174 -1.047 . . . . 25.0 108.174 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 5' ' ' PHE . 49.5 tp -92.29 129.51 38.21 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.317 0.385 . . . . 25.0 111.907 -178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -122.69 134.11 54.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.342 -2.096 . . . . 25.0 105.342 167.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -113.95 112.69 23.72 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 104.852 -2.277 . . . . 25.0 104.852 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -140.44 173.44 11.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.577 -0.527 . . . . 25.0 109.577 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 84.5 p -122.51 159.51 27.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.737 1.014 . . . . 25.0 113.737 -177.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.89 72.11 62.49 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 107.444 -1.317 . . . . 25.0 107.444 177.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -82.88 -60.67 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.753 0 N-CA-C 117.62 2.123 . . . . 25.0 117.62 -170.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 p -80.63 111.04 16.69 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.938 1.088 . . . . 25.0 113.938 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.33 14.91 76.98 Favored Glycine 0 C--O 1.221 -0.684 0 C-N-CA 120.706 -0.759 . . . . 25.0 113.795 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.7 mt -124.93 149.57 47.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.782 0.791 . . . . 25.0 112.225 -171.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 m -139.16 148.77 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 122.839 0.456 . . . . 25.0 109.87 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -93.41 131.41 38.62 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.979 -0.451 . . . . 25.0 110.003 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.6 t -115.97 109.18 17.21 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.628 -0.879 . . . . 25.0 108.628 176.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -65.69 -28.27 68.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.367 0.506 . . . . 25.0 112.367 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.1 p -70.62 -34.57 72.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.687 0.28 . . . . 25.0 110.494 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.7 t -79.38 -21.85 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.655 -0.498 . . . . 25.0 109.655 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 59.31 29.73 19.33 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.412 -0.959 . . . . 25.0 108.412 -171.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.9 p -144.55 168.46 20.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.114 -0.948 . . . . 25.0 110.126 -174.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.1 t -105.23 134.77 47.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.714 -1.958 . . . . 25.0 105.714 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.8 p -121.03 159.9 24.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.935 0.398 . . . . 25.0 110.056 -176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.8 t90 . . . . . 0 C--N 1.321 -0.632 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 175.081 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 121.329 0.585 . . . . 25.0 111.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.41 ' CD1' HD13 ' A' ' 31' ' ' LEU . 60.0 t80 -57.16 -44.6 83.62 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.855 1.058 . . . . 25.0 113.855 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 m -100.91 1.44 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.905 0.383 . . . . 25.0 111.931 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.47 134.64 39.47 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 107.604 -1.258 . . . . 25.0 107.604 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.17 13.72 81.54 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.988 -0.625 . . . . 25.0 112.482 -177.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -118.62 155.59 30.7 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.915 -1.143 . . . . 25.0 107.915 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.85 155.87 28.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 105.586 -2.005 . . . . 25.0 105.586 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -70.23 148.74 48.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.69 -1.226 . . . . 25.0 107.69 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.81 -173.39 24.05 Favored Glycine 0 C--O 1.238 0.394 0 N-CA-C 110.037 -1.225 . . . . 25.0 110.037 -176.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 23' ' ' PHE . 46.7 mt -96.49 153.7 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.611 0.706 . . . . 25.0 110.551 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -135.46 149.02 68.33 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 107.925 -1.139 . . . . 25.0 107.925 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -67.11 144.31 68.83 Favored 'Trans proline' 0 C--N 1.355 0.904 0 N-CA-C 115.632 1.359 . . . . 25.0 115.632 -173.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 p-10 -83.73 154.22 64.83 Favored Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.83 -24.21 2.3 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 N-CA-C 118.442 2.439 . . . . 25.0 118.442 -172.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -140.48 -36.45 0.48 Allowed 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.641 2.089 . . . . 25.0 116.641 -170.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 19.6 mp0 -76.91 176.71 8.33 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.711 -0.677 . . . . 25.0 111.341 -172.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -69.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.744 1.016 . . . . 25.0 113.744 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -113.61 16.59 18.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.054 1.502 . . . . 25.0 115.054 -172.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.4 p -79.93 172.01 14.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.363 -0.976 . . . . 25.0 108.363 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.408 ' CD2' HD22 ' A' ' 13' ' ' LEU . 8.9 p90 -156.61 170.73 21.72 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.37 0.605 . . . . 25.0 110.332 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -103.66 150.03 24.39 Favored 'General case' 0 CA--C 1.502 -0.866 0 N-CA-C 103.104 -2.924 . . . . 25.0 103.104 170.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.6 t -133.99 133.07 40.87 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.2 m -107.85 127.35 53.64 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.712 -1.958 . . . . 25.0 105.712 174.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.98 121.55 14.18 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.104 -1.443 . . . . 25.0 107.104 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.09 31.88 19.02 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.875 0.87 . . . . 25.0 110.034 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.54 9.55 69.26 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.885 -0.598 . . . . 25.0 114.533 -178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -103.56 150.01 24.35 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.064 -1.087 . . . . 25.0 108.064 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.41 HD13 ' CD1' ' A' ' 5' ' ' PHE . 54.1 tp -91.3 130.01 37.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.39 0.515 . . . . 25.0 112.39 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -122.86 134.74 54.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.74 -1.948 . . . . 25.0 105.74 167.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -113.94 123.31 49.44 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 104.959 -2.237 . . . . 25.0 104.959 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -138.57 161.31 37.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.959 0.409 . . . . 25.0 111.19 -174.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.0 p -110.43 141.22 43.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 177.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -98.99 127.81 33.99 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 102.909 -2.997 . . . . 25.0 102.909 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.74 -106.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 N-CA-C 116.052 1.52 . . . . 25.0 116.052 -166.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.2 t -105.58 152.82 22.6 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.448 -0.783 . . . . 25.0 112.372 -174.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.62 2.4 64.02 Favored Glycine 0 C--O 1.235 0.206 0 N-CA-C 114.767 0.667 . . . . 25.0 114.767 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 51' ' ' TRP . 48.2 mt -131.58 155.28 47.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 25.0 111.279 -174.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.85 157.28 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 107.643 -1.244 . . . . 25.0 107.643 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -82.74 130.29 35.1 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.2 t -115.94 109.79 18.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.512 0.672 . . . . 25.0 109.631 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.49 -25.66 68.09 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.324 0.861 . . . . 25.0 113.324 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.4 p -66.5 -38.11 86.53 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.922 0.712 . . . . 25.0 112.922 -175.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.1 p -104.02 -8.23 19.72 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.391 -0.596 . . . . 25.0 109.391 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.4 tptt 63.29 33.01 14.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.108 -0.951 . . . . 25.0 112.044 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 163.84 20.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.424 -0.807 . . . . 25.0 110.271 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -86.86 125.13 33.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 102.898 -3.001 . . . . 25.0 102.898 165.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.2 p -121.24 161.75 21.41 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.401 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.9 t90 . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.094 -0.957 . . . . 25.0 110.849 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.7 p . . . . . 0 C--O 1.218 -0.576 0 CA-C-O 120.949 0.404 . . . . 25.0 110.789 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.26 -35.84 60.48 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.756 1.762 . . . . 25.0 115.756 -174.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.7 t -105.11 -6.61 19.76 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.121 0.486 . . . . 25.0 111.244 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -71.83 127.45 32.59 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.264 -0.898 . . . . 25.0 109.138 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.55 5.39 88.46 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.977 -0.63 . . . . 25.0 113.28 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -107.68 145.51 33.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 117.475 0.637 . . . . 25.0 110.11 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.15 153.71 41.49 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.145 -1.057 . . . . 25.0 108.145 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -67.21 160.45 26.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.079 -0.51 . . . . 25.0 109.721 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.54 16.5 Favored Glycine 0 C--O 1.235 0.158 0 N-CA-C 110.601 -0.999 . . . . 25.0 110.601 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 mt -96.38 147.27 23.99 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -129.77 151.72 78.61 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 106.201 -1.778 . . . . 25.0 106.201 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.59 144.44 60.52 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 117.799 -1.001 . . . . 25.0 113.815 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -80.99 158.08 70.58 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.875 0.87 . . . . 25.0 112.598 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -86.52 -23.67 1.72 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 N-CA-C 119.093 2.69 . . . . 25.0 119.093 -172.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -136.29 -44.72 0.62 Allowed 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 115.588 1.699 . . . . 25.0 115.588 -170.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -71.24 166.37 21.69 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.69 -1.141 . . . . 25.0 111.326 -173.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.9 tpt85 -77.2 -39.51 48.45 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.696 0.998 . . . . 25.0 113.696 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -128.39 3.73 5.68 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 118.95 2.944 . . . . 25.0 118.95 -167.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.8 p -85.89 178.07 7.41 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.301 -1.5 . . . . 25.0 109.265 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -143.14 170.98 14.71 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.456 0.646 . . . . 25.0 109.792 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -101.42 144.52 30.11 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 101.727 -3.434 . . . . 25.0 101.727 167.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -135.56 136.67 41.31 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 107.659 -1.237 . . . . 25.0 107.659 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.97 129.9 56.03 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.78 117.62 8.75 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.62 33.96 22.25 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.74 0.816 . . . . 25.0 110.815 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.75 5.49 74.52 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.299 -0.477 . . . . 25.0 114.179 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -100.87 144.59 29.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.243 -1.021 . . . . 25.0 108.243 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -91.31 128.67 37.23 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.289 -0.414 . . . . 25.0 111.61 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.27 133.74 55.15 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 169.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -116.21 107.81 15.34 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 104.88 -2.267 . . . . 25.0 104.88 175.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -146.5 172.84 12.95 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 120.469 0.176 . . . . 25.0 110.971 -169.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.5 p -114.17 164.13 14.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 171.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.55 127.64 55.82 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 106.782 -1.562 . . . . 25.0 106.782 178.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.33 -52.05 0.93 Allowed 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 116.489 -1.874 . . . . 25.0 116.335 -172.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.78 131.23 53.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.984 0.735 . . . . 25.0 112.984 -178.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.34 22.75 78.56 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.213 -0.994 . . . . 25.0 115.191 168.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.44 118.98 3.67 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -149.36 157.27 6.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 102.755 -3.054 . . . . 25.0 102.755 160.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -119.92 132.3 55.49 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.8 t -116.34 111.89 20.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.925 -0.768 . . . . 25.0 108.925 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -62.75 -30.42 71.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.596 -0.729 . . . . 25.0 111.991 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.3 p -67.78 -33.09 74.14 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 112.655 0.613 . . . . 25.0 112.655 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.1 -5.61 43.85 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.694 -0.484 . . . . 25.0 109.694 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.95 29.09 17.11 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.582 0.753 . . . . 25.0 109.671 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -141.88 166.57 24.35 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 113.663 0.986 . . . . 25.0 113.663 -167.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.8 t -79.91 138.48 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.685 -1.598 . . . . 25.0 106.685 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.3 p -124.33 167.98 13.61 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.939 -1.504 . . . . 25.0 106.939 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.07 0.462 . . . . 25.0 109.97 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.2 p . . . . . 0 N--CA 1.468 0.451 0 CA-C-O 121.283 0.564 . . . . 25.0 111.904 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -56.94 -43.67 81.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.8 t -108.67 -16.41 14.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.386 0.613 . . . . 25.0 111.316 -178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -67.45 127.72 33.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 O-C-N 120.909 -1.119 . . . . 25.0 110.984 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.76 20.25 74.13 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 120.963 -0.637 . . . . 25.0 112.849 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -118.07 161.89 19.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.49 39.73 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.134 -1.802 . . . . 25.0 106.134 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -66.87 146.08 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.227 -1.397 . . . . 25.0 107.227 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.05 -178.36 25.69 Favored Glycine 0 C--N 1.322 -0.239 0 N-CA-C 110.993 -0.843 . . . . 25.0 110.993 -176.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 23' ' ' PHE . 26.2 mt -96.46 144.78 26.25 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.213 0.53 . . . . 25.0 112.023 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -131.7 154.28 81.76 Favored Pre-proline 0 C--N 1.322 -0.62 0 N-CA-C 108.638 -0.875 . . . . 25.0 108.638 -177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.11 137.59 37.74 Favored 'Trans proline' 0 C--N 1.351 0.663 0 N-CA-C 115.802 1.424 . . . . 25.0 115.802 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -83.51 159.2 61.88 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 125.121 1.368 . . . . 25.0 111.476 -178.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.58 -24.8 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 N-CA-C 118.408 2.426 . . . . 25.0 118.408 -172.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -147.42 -44.41 0.17 Allowed 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.779 2.14 . . . . 25.0 116.779 -171.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -68.72 162.49 26.04 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 113.488 0.921 . . . . 25.0 113.488 -168.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -82.61 -34.54 27.59 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.233 0.827 . . . . 25.0 113.233 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.1 t -107.91 -21.71 12.73 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.426 1.639 . . . . 25.0 115.426 -170.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 80.5 p -82.56 164.03 21.11 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.342 -0.848 . . . . 25.0 112.706 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.426 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.2 p90 -142.38 174.27 10.77 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -104.64 146.45 28.91 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 102.75 -3.056 . . . . 25.0 102.75 168.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.3 t -132.46 134.46 45.1 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.23 -1.396 . . . . 25.0 107.23 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.1 t -110.96 119.93 40.71 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 102.071 -3.307 . . . . 25.0 102.071 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.77 121.67 11.31 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.295 -0.631 . . . . 25.0 109.295 -175.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.36 31.23 18.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.057 0.943 . . . . 25.0 110.99 -176.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.55 8.43 84.06 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.149 -0.548 . . . . 25.0 113.689 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.72 151.43 30.26 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.642 -0.503 . . . . 25.0 109.642 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.29 132.27 34.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.976 -0.556 . . . . 25.0 111.343 -177.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -128.67 139.1 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.264 -1.754 . . . . 25.0 106.264 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -121.23 111.38 17.31 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.296 -2.113 . . . . 25.0 105.296 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.62 176.4 8.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.792 -0.818 . . . . 25.0 108.792 -171.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 75.5 p -124.28 156.38 37.02 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 115.477 1.658 . . . . 25.0 115.477 -174.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -112.27 98.0 41.5 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.191 -1.411 . . . . 25.0 107.191 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.44 -91.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.302 0 N-CA-C 117.146 1.941 . . . . 25.0 117.146 -172.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -77.34 115.79 17.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 115.197 1.555 . . . . 25.0 115.197 -171.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 2.68 55.53 Favored Glycine 0 C--O 1.227 -0.312 0 N-CA-C 115.332 0.893 . . . . 25.0 115.332 172.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -105.1 134.66 47.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.108 0.454 . . . . 25.0 110.064 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -126.5 146.1 32.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -81.9 132.64 35.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -118.89 109.33 15.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.014 0.912 . . . . 25.0 108.634 176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.99 -26.7 68.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.46 -0.791 . . . . 25.0 112.88 -176.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p -67.8 -29.76 69.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.542 0.571 . . . . 25.0 112.542 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 32.0 p -103.68 -5.3 22.72 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 121.425 -0.11 . . . . 25.0 111.225 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 54.66 39.44 31.26 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.6 p -146.88 168.77 20.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.57 -0.741 . . . . 25.0 110.299 -172.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 137.98 38.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.227 -1.768 . . . . 25.0 106.227 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -124.46 149.96 46.24 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.742 0.306 . . . . 25.0 110.201 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.8 t90 . . . . . 0 C--N 1.324 -0.53 0 N-CA-C 107.846 -1.168 . . . . 25.0 107.846 174.996 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.215 -0.725 0 CA-C-O 121.324 0.583 . . . . 25.0 110.502 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -55.69 -29.4 59.34 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.997 1.11 . . . . 25.0 113.997 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.2 t -112.31 -10.56 13.79 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.204 0.526 . . . . 25.0 112.396 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -72.68 126.68 30.47 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.327 -0.858 . . . . 25.0 109.376 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.04 2.1 84.04 Favored Glycine 0 C--O 1.225 -0.451 0 C-N-CA 121.302 -0.475 . . . . 25.0 113.004 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -101.03 147.56 26.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 O-C-N 122.264 -0.551 . . . . 25.0 111.839 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.13 161.47 26.87 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.872 -1.159 . . . . 25.0 107.872 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -72.32 179.8 3.25 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.228 0.537 . . . . 25.0 110.803 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.28 -176.63 24.55 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 112.046 -0.422 . . . . 25.0 112.046 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.76 145.76 25.52 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.006 0.432 . . . . 25.0 111.834 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.67 147.2 57.56 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 108.997 -0.742 . . . . 25.0 108.997 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.76 155.62 65.44 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 114.661 0.985 . . . . 25.0 114.661 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -95.24 153.81 39.61 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.129 0.972 . . . . 25.0 110.903 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.05 -26.57 10.7 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 117.149 -1.434 . . . . 25.0 115.711 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -163.76 -78.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.232 0.469 . . . . 25.0 111.258 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 38.62 -129.22 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.142 0.977 . . . . 25.0 112.297 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -136.43 -55.93 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.486 0.714 . . . . 25.0 110.152 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 m -156.56 47.4 0.45 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.161 0.43 . . . . 25.0 112.161 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -133.13 169.7 16.48 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 115.904 -0.589 . . . . 25.0 111.469 -174.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -153.64 174.34 14.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.978 -1.489 . . . . 25.0 106.978 -175.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -105.42 160.83 14.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.57 141.51 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.521 -0.918 . . . . 25.0 108.521 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.6 127.24 55.08 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 128.33 14.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.062 -1.459 . . . . 25.0 107.062 178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.34 30.67 10.58 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.095 0.776 . . . . 25.0 113.095 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.91 9.14 79.31 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.427 -0.416 . . . . 25.0 113.922 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -110.4 147.4 34.09 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.479 -0.934 . . . . 25.0 108.479 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -89.82 130.27 36.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.308 -0.86 . . . . 25.0 110.381 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -120.75 149.54 42.38 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.029 -2.582 . . . . 25.0 104.029 168.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -118.64 137.8 53.03 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 103.051 -2.944 . . . . 25.0 103.051 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -133.61 168.45 18.66 Favored 'General case' 0 CA--C 1.503 -0.863 0 O-C-N 123.293 0.37 . . . . 25.0 110.968 -173.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.0 p -136.9 159.1 42.86 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 102.145 -3.279 . . . . 25.0 102.145 170.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.1 m -123.17 78.54 52.26 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 104.091 -2.559 . . . . 25.0 104.091 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 -47.46 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 116.871 -1.619 . . . . 25.0 115.825 -167.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -100.95 116.21 32.26 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.055 1.131 . . . . 25.0 114.055 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.54 -11.44 6.99 Favored Glycine 0 N--CA 1.463 0.452 0 N-CA-C 118.791 2.277 . . . . 25.0 118.791 170.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.7 mt -120.79 152.66 38.08 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.44 1.12 . . . . 25.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.8 m -136.63 144.33 32.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.634 -0.876 . . . . 25.0 108.634 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.415 ' HA ' ' HA ' ' A' ' 49' ' ' CYS . 19.2 t80 -74.68 127.15 32.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.0 0.429 . . . . 25.0 110.927 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -112.88 111.49 22.29 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 122.033 0.92 . . . . 25.0 108.801 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -63.78 -21.97 66.68 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.781 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.2 p -67.95 -34.92 77.51 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.491 0.552 . . . . 25.0 112.491 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 3.1 p -104.28 -9.78 18.32 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 121.109 -0.236 . . . . 25.0 111.441 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 63.11 33.98 14.07 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.899 0.88 . . . . 25.0 110.591 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -142.83 166.68 23.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.642 -0.708 . . . . 25.0 109.26 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 42' ' ' PHE . 30.7 m -86.8 146.83 26.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 106.735 -1.579 . . . . 25.0 106.735 169.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.17 160.7 27.27 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.2 t90 . . . . . 0 C--N 1.321 -0.65 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.354 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.533 0.298 0 N-CA-C 113.33 0.863 . . . . 25.0 113.33 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -62.01 -41.47 98.1 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.747 -0.596 . . . . 25.0 112.465 -177.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.4 -12.0 9.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.576 0.703 . . . . 25.0 111.027 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.65 128.66 37.25 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 121.445 -0.785 . . . . 25.0 110.236 -177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.97 16.41 80.7 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 121.058 -0.592 . . . . 25.0 112.851 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -114.15 148.42 37.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 117.007 0.403 . . . . 25.0 110.647 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.15 150.81 47.11 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.472 -0.936 . . . . 25.0 108.472 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -68.77 164.66 21.31 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.357 0.598 . . . . 25.0 110.677 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.92 -175.13 16.0 Favored Glycine 0 CA--C 1.516 0.113 0 N-CA-C 110.306 -1.118 . . . . 25.0 110.306 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.1 mt -93.59 152.06 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.699 1.0 . . . . 25.0 113.699 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -133.68 148.79 69.95 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.98 145.5 35.82 Favored 'Trans proline' 0 C--N 1.349 0.555 0 N-CA-C 114.281 0.839 . . . . 25.0 114.281 -174.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -102.56 120.34 53.3 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 110.123 -0.325 . . . . 25.0 110.123 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.04 -18.1 14.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 116.31 -1.993 . . . . 25.0 113.808 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -70.34 -52.21 24.37 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 111.977 0.362 . . . . 25.0 111.977 -175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.81 141.07 52.17 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.26 -18.75 44.89 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.338 1.066 . . . . 25.0 108.326 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -77.71 -0.87 28.51 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.292 -1.777 . . . . 25.0 113.323 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 60.7 p -137.65 170.09 16.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.578 0.704 . . . . 25.0 112.172 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -143.52 172.56 12.62 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 25.0 108.741 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -107.79 152.8 23.88 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 102.959 -2.978 . . . . 25.0 102.959 171.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.7 t -140.02 142.75 36.22 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.49 128.91 56.47 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.682 -2.34 . . . . 25.0 104.682 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.55 113.72 6.94 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 107.234 -1.395 . . . . 25.0 107.234 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.35 34.86 24.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.786 0.834 . . . . 25.0 110.189 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.65 -1.49 57.7 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.691 0.636 . . . . 25.0 114.691 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -88.82 150.14 23.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.341 -0.985 . . . . 25.0 108.341 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.85 124.63 37.98 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 123.597 0.56 . . . . 25.0 109.821 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -118.99 136.5 54.07 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.275 -1.38 . . . . 25.0 107.275 172.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -117.28 118.36 32.05 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -142.06 157.92 44.35 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.158 0.435 . . . . 25.0 110.838 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 48.8 p -94.1 162.44 13.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.554 . . . . 25.0 109.886 177.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 44.9 t -114.62 122.63 33.59 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 107.258 -1.386 . . . . 25.0 107.258 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.62 -41.49 0.25 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 115.977 -2.215 . . . . 25.0 117.584 -173.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.1 m -103.66 117.32 34.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 115.653 1.723 . . . . 25.0 115.653 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.17 21.39 79.25 Favored Glycine 0 C--O 1.21 -1.404 0 C-N-CA 120.499 -0.857 . . . . 25.0 113.322 171.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -46.55 104.73 0.05 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 119.851 3.278 . . . . 25.0 119.851 -162.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -149.06 162.69 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 104.507 -2.405 . . . . 25.0 104.507 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -112.22 131.06 55.7 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.774 -0.579 . . . . 25.0 110.802 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 t -107.07 113.72 27.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.474 -0.565 . . . . 25.0 109.474 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.71 -35.32 79.36 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.657 0.614 . . . . 25.0 112.657 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.0 p -69.1 -33.14 73.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 120.769 0.319 . . . . 25.0 111.067 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 46.1 t -81.86 -22.13 37.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.672 -0.492 . . . . 25.0 109.672 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.2 tptt 59.97 26.86 16.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.684 -1.228 . . . . 25.0 107.684 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.0 p -142.03 167.86 21.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.273 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.47 138.06 35.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.0 p -131.39 168.01 18.32 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.905 -0.776 . . . . 25.0 108.905 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.6 m0 . . . . . 0 C--N 1.324 -0.525 0 N-CA-C 109.26 -0.645 . . . . 25.0 109.26 176.365 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 C--O 1.222 -0.349 0 CA-C-O 121.593 0.711 . . . . 25.0 111.824 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.401 ' CD1' HD22 ' A' ' 31' ' ' LEU . 81.8 t80 -63.01 -41.16 99.49 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.8 t -95.99 -17.26 21.13 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.602 0.715 . . . . 25.0 111.007 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -68.16 132.39 47.1 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.069 -1.019 . . . . 25.0 109.071 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.44 12.81 79.83 Favored Glycine 0 C--O 1.226 -0.389 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.303 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -122.27 163.23 20.02 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.235 -1.395 . . . . 25.0 107.235 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.4 32.88 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 106.313 -1.736 . . . . 25.0 106.313 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.44 148.12 49.99 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.127 -1.064 . . . . 25.0 108.127 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.12 -177.28 23.66 Favored Glycine 0 C--O 1.237 0.315 0 N-CA-C 111.23 -0.748 . . . . 25.0 111.23 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.6 mt -96.46 139.75 32.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.146 0.498 . . . . 25.0 110.777 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -125.11 152.85 71.27 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 107.997 -1.112 . . . . 25.0 107.997 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.42 147.42 71.3 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 118.004 -0.864 . . . . 25.0 113.791 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -86.49 159.46 52.86 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 115.145 -0.934 . . . . 25.0 111.585 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -83.86 -20.19 4.6 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 118.032 2.282 . . . . 25.0 118.032 -172.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -146.01 -47.06 0.2 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.171 2.285 . . . . 25.0 117.171 -169.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -72.24 169.99 15.03 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.243 -0.435 . . . . 25.0 111.056 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -81.97 -50.49 9.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.192 1.182 . . . . 25.0 114.192 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 m -112.57 18.59 18.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 116.13 1.9 . . . . 25.0 116.13 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 86.9 p -102.07 165.46 11.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.173 0.442 . . . . 25.0 110.407 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -142.16 174.5 10.55 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.725 -0.843 . . . . 25.0 108.725 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -105.42 136.21 45.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 103.266 -2.865 . . . . 25.0 103.266 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -121.45 120.24 34.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.799 -1.185 . . . . 25.0 107.799 177.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.9 t -103.74 121.39 42.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 105.146 -2.168 . . . . 25.0 105.146 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -148.33 118.59 7.31 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.886 -0.413 . . . . 25.0 109.886 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.38 35.92 24.19 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.714 0.806 . . . . 25.0 112.335 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.01 3.38 84.58 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.071 -0.585 . . . . 25.0 113.639 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -104.74 150.8 24.45 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.053 -1.091 . . . . 25.0 108.053 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.401 HD22 ' CD1' ' A' ' 5' ' ' PHE . 62.7 tp -107.81 132.81 53.01 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.006 -0.739 . . . . 25.0 109.006 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -123.18 134.99 54.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 104.934 -2.247 . . . . 25.0 104.934 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -113.88 108.12 16.63 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 104.932 -2.247 . . . . 25.0 104.932 174.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -135.68 177.06 8.12 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 79.8 p -126.08 168.6 13.76 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -176.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 81.2 m -100.19 98.23 7.37 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 105.739 -1.948 . . . . 25.0 105.739 171.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -84.98 -96.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 0 N-CA-C 116.002 1.501 . . . . 25.0 116.002 -172.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -73.78 114.89 12.57 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.187 -0.945 . . . . 25.0 113.402 -172.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.18 11.54 75.32 Favored Glycine 0 C--O 1.229 -0.209 0 CA-C-N 115.681 -0.691 . . . . 25.0 114.048 174.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 39.5 mt -124.95 153.73 42.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.48 0.64 . . . . 25.0 112.057 -173.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.0 m -139.23 161.66 28.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.021 -1.103 . . . . 25.0 108.021 177.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -93.21 132.75 37.09 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -111.24 101.91 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.249 0.547 . . . . 25.0 109.628 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.47 -19.09 64.44 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.704 1.001 . . . . 25.0 113.704 -175.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 p -71.65 -52.09 19.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.969 -0.457 . . . . 25.0 111.302 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.09 -1.99 32.65 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.034 0.753 . . . . 25.0 113.034 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.0 mptt 64.94 35.13 8.5 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.443 1.097 . . . . 25.0 108.457 177.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.6 m -105.58 157.21 17.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.233 -0.894 . . . . 25.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.1 t -103.26 121.64 43.13 Favored 'General case' 0 C--N 1.321 -0.652 1 N-CA-C 99.807 -4.146 . . . . 25.0 99.807 162.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -141.12 167.82 21.27 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -169.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 121.24 0.543 . . . . 25.0 111.916 -178.643 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 115.905 1.817 . . . . 25.0 115.905 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -60.33 -39.4 86.91 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.482 -0.761 . . . . 25.0 112.971 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.07 -0.57 15.61 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 112.515 0.561 . . . . 25.0 112.515 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.36 127.33 32.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 108.889 -0.782 . . . . 25.0 108.889 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.22 13.84 82.87 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 121.137 -0.554 . . . . 25.0 112.508 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -104.9 147.12 28.11 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.4 154.16 38.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 106.844 -1.539 . . . . 25.0 106.844 177.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.19 149.4 49.59 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.529 -0.915 . . . . 25.0 108.529 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.72 -175.1 20.46 Favored Glycine 0 C--O 1.234 0.105 0 N-CA-C 111.329 -0.708 . . . . 25.0 111.329 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.405 HD22 ' CD2' ' A' ' 23' ' ' PHE . 42.9 mt -97.93 147.49 24.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 25.0 112.286 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -128.49 147.64 64.83 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 107.729 -1.211 . . . . 25.0 107.729 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -73.57 150.77 46.21 Favored 'Trans proline' 0 C--N 1.346 0.421 0 N-CA-C 114.453 0.905 . . . . 25.0 114.453 -175.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -94.35 121.45 63.53 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.108 -1.071 . . . . 25.0 108.108 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.71 -18.82 21.89 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 116.262 -2.025 . . . . 25.0 113.718 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -88.66 -36.62 16.13 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 111.917 0.34 . . . . 25.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -116.09 149.45 38.94 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 114.328 1.233 . . . . 25.0 114.328 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -79.63 -58.07 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.88 -1.054 . . . . 25.0 112.037 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.8 m -98.0 21.56 10.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 116.124 1.898 . . . . 25.0 116.124 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 54.4 p -134.43 159.47 40.97 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.158 -0.682 . . . . 25.0 109.158 175.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.405 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.1 p90 -138.15 176.27 8.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.487 -0.778 . . . . 25.0 110.767 -172.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -107.85 144.93 34.37 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 104.116 -2.55 . . . . 25.0 104.116 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -130.13 140.2 50.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -120.69 133.05 55.38 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.507 -1.294 . . . . 25.0 107.507 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 109.48 4.47 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.3 36.39 26.96 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.645 0.736 . . . . 25.0 110.635 -177.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.29 -5.5 59.65 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 114.788 0.675 . . . . 25.0 114.788 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 mmt85 -84.15 148.93 26.51 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.251 -1.389 . . . . 25.0 107.251 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 131.46 52.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.963 -0.384 . . . . 25.0 109.963 -177.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -123.54 139.42 54.03 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 107.958 -1.126 . . . . 25.0 107.958 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -119.82 111.71 18.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.375 -1.713 . . . . 25.0 106.375 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -140.27 168.19 20.39 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.902 -0.407 . . . . 25.0 109.902 -173.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 62.1 p -112.2 159.5 18.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.088 0.774 . . . . 25.0 113.088 -176.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.86 90.12 50.2 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 105.434 -2.062 . . . . 25.0 105.434 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -79.79 -89.17 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 N-CA-C 117.053 1.905 . . . . 25.0 117.053 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -77.23 115.13 16.76 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.695 1.369 . . . . 25.0 114.695 -169.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 1.01 50.04 Favored Glycine 0 CA--C 1.519 0.304 0 N-CA-C 115.23 0.852 . . . . 25.0 115.23 174.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -103.71 134.31 47.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.795 0.331 . . . . 25.0 110.482 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.3 m -131.6 147.17 32.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.138 0.494 . . . . 25.0 110.12 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -80.61 135.83 36.13 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.629 -0.508 . . . . 25.0 109.629 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.6 t -109.45 101.54 10.49 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 107.866 -1.161 . . . . 25.0 107.866 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.37 -27.82 67.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.531 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 p -70.03 -41.26 74.48 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.224 0.453 . . . . 25.0 112.224 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.6 p -96.74 -10.47 26.75 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 -175.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mptt 66.4 31.11 8.45 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.183 0.993 . . . . 25.0 109.232 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.16 163.04 27.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.635 -0.711 . . . . 25.0 109.441 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.7 t -106.87 138.69 42.56 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 104.162 -2.533 . . . . 25.0 104.162 173.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -141.0 164.36 30.48 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.749 -0.463 . . . . 25.0 109.749 -174.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.2 t90 . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 107.667 -1.234 . . . . 25.0 107.667 175.711 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.8 p . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 121.286 0.565 . . . . 25.0 112.219 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -59.4 -33.49 71.28 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 t -105.62 -11.38 16.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.287 0.565 . . . . 25.0 111.403 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -71.95 132.2 44.0 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.35 14.89 77.8 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.906 -0.664 . . . . 25.0 111.904 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -110.24 143.59 40.17 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.156 -0.683 . . . . 25.0 109.156 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.1 152.62 36.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 104.351 -2.463 . . . . 25.0 104.351 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -68.01 149.47 49.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.055 -0.72 . . . . 25.0 109.055 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.48 -176.11 21.61 Favored Glycine 0 N--CA 1.459 0.216 0 N-CA-C 110.88 -0.888 . . . . 25.0 110.88 -177.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.3 mt -94.71 145.51 24.8 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.88 0.84 . . . . 25.0 110.32 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -127.92 150.32 73.18 Favored Pre-proline 0 C--O 1.238 0.482 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.245 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.49 148.97 74.13 Favored 'Trans proline' 0 C--N 1.352 0.724 0 N-CA-C 114.127 0.78 . . . . 25.0 114.127 -178.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB3' ' HA ' ' A' ' 23' ' ' PHE . 12.6 p-10 -102.71 150.54 37.8 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 114.869 -1.06 . . . . 25.0 111.448 -173.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.01 -30.0 7.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 N-CA-C 116.578 1.722 . . . . 25.0 116.578 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -78.34 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.931 0.787 . . . . 25.0 112.243 -176.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 34.43 -120.12 0.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.828 1.251 . . . . 25.0 113.262 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.6 tpt180 -155.82 -56.99 0.09 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.789 0.662 . . . . 25.0 112.789 177.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.1 m -153.68 39.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 p -137.93 157.27 46.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 -174.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.456 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 0.1 OUTLIER -149.42 175.9 11.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.398 -0.819 . . . . 25.0 108.88 -167.126 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -98.56 154.32 18.0 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.615 -0.883 . . . . 25.0 108.615 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -139.81 131.85 27.9 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -110.28 134.33 52.36 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 106.144 -1.798 . . . . 25.0 106.144 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.09 126.89 11.79 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.36 31.35 14.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.545 0.738 . . . . 25.0 111.895 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.16 69.75 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 115.434 0.934 . . . . 25.0 115.434 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -112.26 149.96 31.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 118.218 1.009 . . . . 25.0 108.483 177.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.95 133.65 33.92 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.226 0.824 . . . . 25.0 113.226 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.47 ' CE1' ' HD2' ' A' ' 30' ' ' ARG . 63.7 m-85 -117.33 146.64 43.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.463 -2.421 . . . . 25.0 104.463 165.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -117.23 131.58 56.82 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.562 -2.755 . . . . 25.0 103.562 169.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -136.88 169.41 17.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.6 0.593 . . . . 25.0 112.6 -168.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -136.31 157.79 45.96 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 101.082 -3.674 . . . . 25.0 101.082 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.8 m -106.45 108.3 61.57 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 103.9 -2.63 . . . . 25.0 103.9 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.35 -51.38 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.482 -1.878 . . . . 25.0 116.917 -164.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -105.75 114.47 28.65 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 115.663 1.727 . . . . 25.0 115.663 -172.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.69 4.04 37.55 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 117.66 1.824 . . . . 25.0 117.66 167.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -118.65 146.69 44.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.462 0.631 . . . . 25.0 111.117 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.07 151.04 33.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.069 -1.086 . . . . 25.0 108.069 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -80.32 118.89 22.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.343 0.592 . . . . 25.0 111.101 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.1 t -95.97 105.85 17.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.818 -1.179 . . . . 25.0 107.818 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -62.35 -28.88 70.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.528 0.566 . . . . 25.0 112.528 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -71.73 -33.48 68.75 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.936 -0.306 . . . . 25.0 111.148 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 51.9 t -84.6 -23.13 29.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 25.0 111.99 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 60.23 30.35 19.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 108.399 -0.963 . . . . 25.0 108.399 -170.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 10.4 p -143.3 165.04 28.58 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.241 -0.89 . . . . 25.0 108.851 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.45 136.47 33.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.706 -1.59 . . . . 25.0 106.706 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 34.0 p -121.16 158.9 26.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.201 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 . . . . . 0 C--N 1.324 -0.506 0 N-CA-C 107.861 -1.163 . . . . 25.0 107.861 178.381 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 122.024 0.916 . . . . 25.0 111.704 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.41 -40.69 71.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.513 -1.221 . . . . 25.0 111.684 173.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.4 t -114.02 -3.82 13.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.521 0.563 . . . . 25.0 112.521 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -63.29 117.68 6.95 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 120.534 -1.354 . . . . 25.0 109.473 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.95 17.39 78.5 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 116.556 -0.293 . . . . 25.0 113.669 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -91.89 145.41 24.57 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.37 148.51 51.53 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 106.862 -1.533 . . . . 25.0 106.862 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -68.24 144.25 54.97 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.63 -177.1 21.48 Favored Glycine 0 C--O 1.242 0.633 0 N-CA-C 109.765 -1.334 . . . . 25.0 109.765 -176.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 23' ' ' PHE . 27.9 mt -96.66 151.8 19.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.264 1.03 . . . . 25.0 112.092 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -132.01 153.45 81.37 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 114.869 -1.059 . . . . 25.0 110.21 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.6 143.44 38.07 Favored 'Trans proline' 0 C--N 1.354 0.851 0 N-CA-C 116.11 1.542 . . . . 25.0 116.11 -174.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -88.73 158.61 47.69 Favored Pre-proline 0 CA--C 1.555 1.167 0 CA-C-N 114.877 -1.056 . . . . 25.0 111.539 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.62 -18.71 3.02 Favored 'Trans proline' 0 C--N 1.353 0.813 0 N-CA-C 118.927 2.626 . . . . 25.0 118.927 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -133.95 -59.77 0.83 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 117.124 2.268 . . . . 25.0 117.124 -172.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -70.38 161.46 30.43 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 114.463 1.283 . . . . 25.0 114.463 -167.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -64.81 -41.97 95.38 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 115.654 1.724 . . . . 25.0 115.654 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.9 m -129.34 3.35 5.14 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.118 1.895 . . . . 25.0 116.118 -173.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.4 p -77.71 165.29 24.41 Favored 'General case' 0 C--O 1.212 -0.874 0 O-C-N 121.208 -0.933 . . . . 25.0 110.122 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.461 ' CD2' HD22 ' A' ' 13' ' ' LEU . 16.5 p90 -148.89 168.69 22.34 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.214 1.007 . . . . 25.0 111.107 177.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -100.98 153.92 19.12 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.882 -2.636 . . . . 25.0 103.882 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.9 t -140.63 149.07 41.83 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 106.785 -1.561 . . . . 25.0 106.785 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m -123.79 129.38 50.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 105.612 -1.995 . . . . 25.0 105.612 176.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.2 119.54 14.74 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.283 -1.006 . . . . 25.0 108.283 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.39 35.38 17.22 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 123.45 0.7 . . . . 25.0 111.965 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.88 14.38 78.47 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.578 0.591 . . . . 25.0 114.578 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -109.48 143.96 38.39 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.57 137.7 37.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.765 0.793 . . . . 25.0 112.684 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -128.95 136.16 49.99 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 106.355 -1.72 . . . . 25.0 106.355 166.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -125.09 113.0 17.16 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 103.891 -2.633 . . . . 25.0 103.891 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -137.14 162.58 33.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.082 0.467 . . . . 25.0 111.418 -170.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -108.36 149.85 28.13 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.162 -0.681 . . . . 25.0 109.162 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.04 120.98 47.17 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 103.322 -2.844 . . . . 25.0 103.322 175.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.45 -84.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 N-CA-C 118.19 2.342 . . . . 25.0 118.19 -165.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.3 m -97.53 114.96 26.95 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.896 1.813 . . . . 25.0 115.896 -169.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.74 26.37 69.6 Favored Glycine 0 C--O 1.221 -0.673 0 N-CA-C 116.436 1.335 . . . . 25.0 116.436 170.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.64 161.97 17.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.083 0.942 . . . . 25.0 111.311 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -138.83 171.35 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 106.583 -1.636 . . . . 25.0 106.583 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -101.69 137.5 39.92 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.921 0.782 . . . . 25.0 110.007 177.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.9 t -116.82 108.17 15.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 122.129 0.966 . . . . 25.0 111.076 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -65.41 -24.28 67.16 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 113.112 0.782 . . . . 25.0 113.112 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -66.61 -40.32 88.76 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.137 -0.352 . . . . 25.0 111.07 -176.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 p -103.89 -7.83 20.16 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.595 -0.442 . . . . 25.0 111.8 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm 62.56 35.45 14.45 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.659 0.783 . . . . 25.0 110.266 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.54 160.75 28.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.49 0.662 . . . . 25.0 110.635 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 43.8 t -86.27 128.2 34.88 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.122 -3.288 . . . . 25.0 102.122 168.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.7 p -126.92 163.97 22.48 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 122.581 0.352 . . . . 25.0 111.363 -172.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t90 . . . . . 0 C--N 1.327 -0.413 0 CA-C-O 120.895 0.379 . . . . 25.0 111.636 -179.419 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 121.797 0.808 . . . . 25.0 109.806 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.71 -36.71 70.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.083 -0.962 . . . . 25.0 111.912 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.72 -0.99 21.42 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.853 0.686 . . . . 25.0 112.853 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -74.53 128.64 36.06 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 121.612 -0.68 . . . . 25.0 109.302 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 76.59 22.18 73.17 Favored Glycine 0 C--O 1.227 -0.288 0 C-N-CA 120.964 -0.636 . . . . 25.0 112.881 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -113.44 148.15 36.46 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.892 -0.781 . . . . 25.0 108.892 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.72 31.02 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.39 142.83 56.6 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.877 -0.786 . . . . 25.0 108.877 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.75 -174.22 22.76 Favored Glycine 0 C--O 1.229 -0.156 0 C-N-CA 121.21 -0.519 . . . . 25.0 113.122 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -96.67 148.83 22.47 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.593 0.357 . . . . 25.0 110.332 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -131.08 148.19 69.28 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-N 116.028 -0.533 . . . . 25.0 111.381 -176.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.12 147.45 60.6 Favored 'Trans proline' 0 C--N 1.351 0.708 0 N-CA-C 113.656 0.599 . . . . 25.0 113.656 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -121.89 150.81 56.77 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 114.965 -1.016 . . . . 25.0 111.259 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -86.12 -18.85 3.34 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 N-CA-C 117.712 2.158 . . . . 25.0 117.712 -174.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -117.16 -58.62 2.04 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 116.453 2.02 . . . . 25.0 116.453 -168.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.4 mp0 -68.3 150.17 48.55 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.202 0.525 . . . . 25.0 111.865 -173.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.16 -65.39 1.02 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-O 121.505 0.669 . . . . 25.0 111.555 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -95.32 24.56 4.96 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.565 0.95 . . . . 25.0 113.565 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.06 162.04 37.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.6 -177.85 6.63 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.298 -1.001 . . . . 25.0 108.298 -163.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -101.82 156.84 17.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.59 -1.633 . . . . 25.0 106.59 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.0 t -143.75 145.6 32.51 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 107.826 -1.176 . . . . 25.0 107.826 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 t -131.73 130.88 42.51 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.25 -1.019 . . . . 25.0 108.25 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.13 123.22 12.11 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.178 -1.045 . . . . 25.0 108.178 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.48 34.39 18.21 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.61 0.764 . . . . 25.0 112.444 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.59 13.35 82.03 Favored Glycine 0 C--O 1.237 0.342 0 C-N-CA 121.217 -0.516 . . . . 25.0 113.862 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -108.26 140.12 41.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.767 -1.198 . . . . 25.0 107.767 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 41.5 tp -87.77 128.65 35.32 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.315 0.384 . . . . 25.0 110.262 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -122.02 140.78 52.08 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 104.421 -2.437 . . . . 25.0 104.421 169.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -114.0 122.15 46.04 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 102.989 -2.967 . . . . 25.0 102.989 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -136.42 164.56 27.87 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 113.739 1.014 . . . . 25.0 113.739 -166.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.3 p -123.37 160.83 25.94 Favored 'General case' 0 C--N 1.32 -0.7 1 N-CA-C 100.191 -4.003 . . . . 25.0 100.191 164.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -101.55 123.5 44.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 106.021 -1.844 . . . . 25.0 106.021 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.43 -55.43 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 115.435 -2.576 . . . . 25.0 116.492 -170.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.58 85.0 6.6 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 115.389 1.625 . . . . 25.0 115.389 -174.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.53 -9.51 0.85 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 118.284 2.073 . . . . 25.0 118.284 168.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 31.6 mt -81.07 155.92 26.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 118.163 0.981 . . . . 25.0 113.11 -166.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.4 m -124.14 151.82 29.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 107.449 -1.315 . . . . 25.0 107.449 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -75.25 126.64 31.44 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.404 -0.81 . . . . 25.0 109.334 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.4 t -109.94 109.49 20.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.403 -0.962 . . . . 25.0 108.403 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.83 -14.01 60.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.723 1.008 . . . . 25.0 113.723 -176.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.5 p -71.48 -47.86 52.89 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.299 -0.876 . . . . 25.0 110.249 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.2 p -92.78 -6.66 48.48 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.772 1.027 . . . . 25.0 113.772 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 59.94 35.16 21.65 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.108 -1.441 . . . . 25.0 107.108 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -142.91 168.03 20.67 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.584 -0.734 . . . . 25.0 110.389 -172.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.73 131.27 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.101 -1.074 . . . . 25.0 108.101 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.86 152.96 43.32 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.699 0.285 . . . . 25.0 110.369 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.0 t90 . . . . . 0 C--N 1.323 -0.583 0 N-CA-C 107.35 -1.352 . . . . 25.0 107.35 174.36 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 C--O 1.222 -0.355 0 CA-C-O 121.881 0.848 . . . . 25.0 109.985 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -56.27 -31.34 63.51 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.302 -0.863 . . . . 25.0 111.384 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.6 t -110.98 -16.28 13.56 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.475 0.917 . . . . 25.0 113.475 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.81 126.14 28.09 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 119.297 -0.961 . . . . 25.0 108.498 177.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 10.88 72.34 Favored Glycine 0 CA--C 1.521 0.454 0 CA-C-N 115.544 -0.753 . . . . 25.0 113.544 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -106.91 149.39 27.51 Favored 'General case' 0 CA--C 1.504 -0.813 0 O-C-N 121.448 -1.03 . . . . 25.0 108.392 178.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.48 151.43 41.05 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 105.83 -1.915 . . . . 25.0 105.83 176.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.78 150.36 49.23 Favored 'General case' 0 C--O 1.246 0.904 0 N-CA-C 107.578 -1.268 . . . . 25.0 107.578 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.0 179.59 19.13 Favored Glycine 0 C--O 1.242 0.612 0 N-CA-C 110.097 -1.201 . . . . 25.0 110.097 -175.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.2 mt -101.33 149.44 24.03 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 112.865 0.691 . . . . 25.0 112.865 -177.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -132.79 144.12 51.57 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 107.622 -1.251 . . . . 25.0 107.622 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.16 149.19 45.59 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 117.32 -1.32 . . . . 25.0 114.249 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -96.3 118.27 65.58 Favored Pre-proline 0 C--O 1.216 -0.702 0 N-CA-C 108.586 -0.894 . . . . 25.0 108.586 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -79.92 -13.18 13.04 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 115.415 1.275 . . . . 25.0 115.415 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -87.41 -42.73 12.62 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.151 0.501 . . . . 25.0 111.167 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -97.94 155.32 17.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.16 -0.927 . . . . 25.0 112.689 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -69.2 -46.85 66.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.521 1.674 . . . . 25.0 115.521 -177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -130.44 20.75 5.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.742 1.756 . . . . 25.0 115.742 -167.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 63.1 p -111.01 164.15 13.11 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -135.13 166.58 22.75 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 122.128 0.966 . . . . 25.0 108.591 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -97.6 145.78 25.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 101.209 -3.626 . . . . 25.0 101.209 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -135.76 138.44 42.66 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.4 m -114.13 123.95 50.88 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.825 -0.805 . . . . 25.0 108.825 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.98 113.62 13.62 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.81 38.54 26.88 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.913 0.758 . . . . 25.0 109.383 -177.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.36 15.2 74.85 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 115.565 0.986 . . . . 25.0 115.565 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -113.57 149.18 34.85 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -93.3 130.44 39.03 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 113.674 0.99 . . . . 25.0 113.674 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.97 137.83 53.23 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 169.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -117.65 108.98 16.09 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 105.332 -2.099 . . . . 25.0 105.332 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.73 165.4 27.39 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.188 -0.32 . . . . 25.0 110.786 -168.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 46.2 p -102.82 164.11 11.82 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.849 0.833 . . . . 25.0 111.623 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.18 95.8 38.2 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 104.5 -2.407 . . . . 25.0 104.5 167.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -91.83 -119.13 0.01 OUTLIER 'Trans proline' 0 C--O 1.25 1.12 0 C-N-CA 120.435 0.757 . . . . 25.0 113.211 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.49 142.61 58.36 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 121.115 -0.99 . . . . 25.0 112.185 -178.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 79.27 -7.6 51.67 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 116.947 1.539 . . . . 25.0 116.947 173.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.6 mt -131.83 142.69 49.79 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.146 0.973 . . . . 25.0 111.773 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.8 149.71 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -90.1 132.39 35.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.657 0.742 . . . . 25.0 112.631 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.8 t -113.32 102.64 10.54 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 121.726 0.774 . . . . 25.0 109.737 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -63.74 -27.75 69.41 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 114.385 1.254 . . . . 25.0 114.385 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 p -67.7 -35.67 79.23 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.053 0.39 . . . . 25.0 112.053 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.3 p -104.83 -7.82 19.16 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.079 0.4 . . . . 25.0 112.079 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm 59.43 44.76 14.57 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.087 1.355 . . . . 25.0 113.069 -174.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.02 168.08 16.56 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.02 -0.991 . . . . 25.0 110.998 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.23 132.3 53.22 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 103.119 -2.919 . . . . 25.0 103.119 168.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 77.1 p -118.69 158.5 25.39 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.76 0.791 . . . . 25.0 111.314 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 115.098 -0.955 . . . . 25.0 109.354 178.654 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.6 p . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 114.136 1.161 . . . . 25.0 114.136 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -64.53 -45.42 87.23 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 113.959 1.096 . . . . 25.0 113.959 -173.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.34 -7.31 13.98 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.563 0.697 . . . . 25.0 111.979 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -70.85 122.51 20.05 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 116.154 -0.476 . . . . 25.0 109.83 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.32 19.95 68.01 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.173 -0.537 . . . . 25.0 113.041 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -119.48 149.86 41.19 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 117.171 0.486 . . . . 25.0 111.097 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 153.27 42.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.245 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 26' ' ' CYS . 72.6 m-20 -70.45 148.41 48.35 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.652 -0.704 . . . . 25.0 110.353 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.23 -179.41 23.26 Favored Glycine 0 CA--C 1.517 0.169 0 N-CA-C 109.942 -1.263 . . . . 25.0 109.942 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -98.75 143.93 28.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.286 1.043 . . . . 25.0 111.108 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.98 148.2 61.95 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.665 -0.495 . . . . 25.0 109.665 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.35 148.86 55.84 Favored 'Trans proline' 0 C--N 1.35 0.614 0 N-CA-C 115.249 1.211 . . . . 25.0 115.249 -175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -84.07 154.77 64.05 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-N 114.408 -1.269 . . . . 25.0 110.38 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -81.48 -21.15 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 N-CA-C 115.981 1.493 . . . . 25.0 115.981 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 -29.67 0.49 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.3 1.593 . . . . 25.0 115.3 -169.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -74.47 -178.51 3.56 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 124.482 1.113 . . . . 25.0 112.349 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -134.96 -56.05 0.82 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.498 -0.751 . . . . 25.0 111.549 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -79.87 -2.84 45.36 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.5 p -130.36 154.58 47.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.437 . . . . 25.0 110.529 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -177.93 6.07 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.279 -1.008 . . . . 25.0 108.279 -170.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -106.04 158.87 16.49 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 176.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.1 t -142.73 153.41 43.3 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.091 -1.448 . . . . 25.0 107.091 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.514 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -126.46 128.29 46.73 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 104.46 -2.422 . . . . 25.0 104.46 175.184 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.85 118.76 11.81 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.97 -1.493 . . . . 25.0 106.97 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.71 33.72 21.91 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.801 0.84 . . . . 25.0 110.352 -173.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.15 7.94 68.46 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 114.619 0.608 . . . . 25.0 114.619 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -101.46 153.26 19.86 Favored 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 121.863 -0.786 . . . . 25.0 108.98 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.98 128.8 33.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.144 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.33 149.52 52.34 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.264 -2.495 . . . . 25.0 104.264 169.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -113.97 146.18 40.49 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 103.125 -2.917 . . . . 25.0 103.125 171.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -129.16 164.7 22.81 Favored 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 109.144 -0.687 . . . . 25.0 109.144 -171.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.0 p -146.58 155.03 42.18 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 102.022 -3.325 . . . . 25.0 102.022 171.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -116.76 117.55 37.52 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 103.086 -2.931 . . . . 25.0 103.086 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.86 -87.6 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 117.528 -1.181 . . . . 25.0 114.676 -171.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.4 t -104.07 153.11 21.27 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.565 -0.709 . . . . 25.0 110.874 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -10.48 4.71 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 118.968 2.347 . . . . 25.0 118.968 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 51' ' ' TRP . 73.5 mt -129.31 144.77 51.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 118.09 0.945 . . . . 25.0 109.439 -176.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.9 m -135.47 147.19 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 109.508 -0.553 . . . . 25.0 109.508 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -77.55 130.34 36.81 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.392 -0.818 . . . . 25.0 109.662 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -126.49 122.73 36.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.49 0.662 . . . . 25.0 109.638 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -64.31 -21.72 66.7 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.4 p -67.67 -32.25 72.78 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.784 0.265 . . . . 25.0 111.467 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.9 t -94.11 -21.75 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.438 -0.578 . . . . 25.0 109.438 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.3 tptt 60.32 26.85 16.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.982 -1.008 . . . . 25.0 108.46 -171.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -143.26 171.69 13.76 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.286 -1.324 . . . . 25.0 107.663 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.3 t -88.25 127.06 35.45 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.433 -1.691 . . . . 25.0 106.433 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 41.8 p -112.67 161.52 16.76 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.409 -0.589 . . . . 25.0 109.409 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.406 ' HA ' HD23 ' A' ' 40' ' ' LEU . 21.6 t90 . . . . . 0 C--N 1.323 -0.583 0 N-CA-C 109.34 -0.615 . . . . 25.0 109.34 177.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.9 p . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 121.263 0.554 . . . . 25.0 111.447 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -58.35 -39.48 79.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.092 0.775 . . . . 25.0 113.092 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.06 2.34 16.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.916 0.71 . . . . 25.0 112.916 -177.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -69.66 123.9 22.58 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.452 -0.573 . . . . 25.0 109.452 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.65 17.93 78.35 Favored Glycine 0 C--O 1.226 -0.37 0 C-N-CA 121.216 -0.516 . . . . 25.0 113.706 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -102.23 145.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-N 117.66 0.73 . . . . 25.0 109.995 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 152.35 44.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.857 -1.065 . . . . 25.0 108.868 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.66 160.39 22.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.667 -0.697 . . . . 25.0 111.899 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.11 -176.55 16.21 Favored Glycine 0 N--CA 1.458 0.143 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.966 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -96.33 151.88 19.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.48 0.657 . . . . 25.0 111.539 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -132.64 147.31 65.04 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 106.094 -1.817 . . . . 25.0 106.094 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.61 146.38 49.09 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 117.368 -1.288 . . . . 25.0 113.528 -175.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -107.59 124.19 35.75 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 116.43 -0.35 . . . . 25.0 110.147 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.71 -15.96 8.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 116.234 1.59 . . . . 25.0 116.234 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -123.24 -47.03 2.03 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 119.554 3.168 . . . . 25.0 119.554 -170.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.36 -65.76 0.51 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 116.273 1.953 . . . . 25.0 116.273 -164.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -172.47 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.985 -0.746 . . . . 25.0 108.985 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.3 p -118.36 14.98 13.88 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.286 -1.746 . . . . 25.0 106.286 175.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 114.251 -1.34 . . . . 25.0 110.374 -178.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -133.32 -179.46 5.52 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.978 -1.119 . . . . 25.0 107.978 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -107.86 145.17 34.05 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.621 -3.103 . . . . 25.0 102.621 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -134.33 143.14 47.51 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 106.609 -1.626 . . . . 25.0 106.609 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.91 127.7 52.1 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 177.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.17 120.59 14.98 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.72 32.25 17.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.645 0.778 . . . . 25.0 111.855 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.2 79.77 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 121.119 -0.562 . . . . 25.0 113.669 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -118.62 148.36 42.79 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.678 -1.23 . . . . 25.0 107.678 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 51.4 tp -91.41 129.17 37.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.53 0.566 . . . . 25.0 112.53 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -120.72 132.56 55.14 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.429 -1.693 . . . . 25.0 106.429 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -113.98 107.34 15.54 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 104.309 -2.478 . . . . 25.0 104.309 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -143.51 169.62 17.36 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.788 -0.449 . . . . 25.0 109.788 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.6 p -117.42 160.07 21.77 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.274 -0.639 . . . . 25.0 109.274 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.53 127.68 55.7 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 107.371 -1.344 . . . . 25.0 107.371 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.83 -55.68 0.25 Allowed 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 116.091 -2.139 . . . . 25.0 117.028 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -106.31 143.75 33.99 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.709 -0.619 . . . . 25.0 112.275 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.08 14.39 70.93 Favored Glycine 0 C--O 1.222 -0.597 0 N-CA-C 115.909 1.124 . . . . 25.0 115.909 169.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.3 111.6 0.6 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 118.945 2.943 . . . . 25.0 118.945 -160.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.3 m -145.62 161.49 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 N-CA-C 104.569 -2.382 . . . . 25.0 104.569 165.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -116.05 130.03 56.63 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.678 -0.49 . . . . 25.0 109.678 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.2 t -110.17 114.22 27.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.843 0.83 . . . . 25.0 109.812 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -63.01 -31.35 72.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.386 -0.824 . . . . 25.0 113.118 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 44.4 p -65.57 -32.07 73.46 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 28.3 p -104.51 -5.38 21.62 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.39 -0.226 . . . . 25.0 110.39 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? 52.3 41.25 30.37 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 -173.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.4 p -143.15 168.37 19.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.613 -0.722 . . . . 25.0 111.417 -172.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.3 t -86.21 139.93 30.61 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.061 -1.459 . . . . 25.0 107.061 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.9 p -128.02 167.84 16.14 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 105.497 -2.038 . . . . 25.0 105.497 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 N-CA-C 106.243 -1.762 . . . . 25.0 106.243 174.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 121.228 0.537 . . . . 25.0 112.055 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.558 ' CD1' HD13 ' A' ' 31' ' ' LEU . 77.1 t80 -64.91 -28.85 69.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.353 -0.385 . . . . 25.0 111.913 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -111.31 10.11 21.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.625 -0.262 . . . . 25.0 111.529 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -73.69 138.8 44.93 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 71.65 17.58 76.65 Favored Glycine 0 C--O 1.227 -0.31 0 C-N-CA 121.027 -0.606 . . . . 25.0 112.733 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -126.33 147.72 49.68 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.125 -0.695 . . . . 25.0 109.125 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.17 156.56 35.76 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -69.94 148.07 49.41 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.744 -1.206 . . . . 25.0 107.744 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.04 -174.39 24.41 Favored Glycine 0 N--CA 1.454 -0.124 0 N-CA-C 110.243 -1.143 . . . . 25.0 110.243 -175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.2 mt -97.64 148.85 22.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.427 0.614 . . . . 25.0 111.347 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -132.13 154.51 81.69 Favored Pre-proline 0 C--O 1.24 0.568 0 N-CA-C 112.111 0.412 . . . . 25.0 112.111 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.413 ' HB3' HD21 ' A' ' 44' ' ' ASN . 59.4 Cg_endo -65.07 131.1 27.55 Favored 'Trans proline' 0 C--N 1.357 0.984 0 N-CA-C 114.346 0.864 . . . . 25.0 114.346 -177.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -118.8 150.69 48.92 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.562 -172.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.65 -19.44 4.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 N-CA-C 117.3 2.0 . . . . 25.0 117.3 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -79.49 -59.85 2.59 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 116.235 1.939 . . . . 25.0 116.235 -166.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.91 151.24 40.8 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.252 0.464 . . . . 25.0 112.252 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -60.45 -33.2 72.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.766 0.826 . . . . 25.0 111.142 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 p -85.69 -0.34 54.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.769 -1.105 . . . . 25.0 113.684 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 91.2 p -122.46 167.54 13.21 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 -178.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -154.83 173.89 15.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.409 0.623 . . . . 25.0 111.764 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -102.83 145.29 29.99 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 102.343 -3.206 . . . . 25.0 102.343 169.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.2 t -135.72 141.62 44.92 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.2 m -117.11 127.54 54.24 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 105.732 -1.951 . . . . 25.0 105.732 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.68 128.52 23.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.835 -1.913 . . . . 25.0 105.835 177.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.29 28.54 13.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.986 0.914 . . . . 25.0 110.578 -173.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 69.17 23.37 76.23 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 121.202 -0.523 . . . . 25.0 113.799 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.1 mmt-85 -123.82 149.37 45.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 117.855 0.827 . . . . 25.0 109.013 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.558 HD13 ' CD1' ' A' ' 5' ' ' PHE . 51.2 tp -79.42 127.9 32.68 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 114.046 1.128 . . . . 25.0 114.046 -177.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -123.86 131.96 53.67 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 167.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -113.98 124.31 51.85 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.202 -1.777 . . . . 25.0 106.202 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -143.49 170.94 14.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.024 -0.361 . . . . 25.0 110.024 -172.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 69.8 p -121.31 162.79 19.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 176.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.5 t -123.14 71.53 44.4 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 106.474 -1.676 . . . . 25.0 106.474 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.27 -27.71 9.36 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 116.201 -2.066 . . . . 25.0 117.277 -164.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.07 86.41 5.53 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.505 1.298 . . . . 25.0 114.505 -175.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.98 2.14 29.31 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.312 2.085 . . . . 25.0 118.312 168.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.0 mt -122.69 162.87 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.215 1.007 . . . . 25.0 111.158 -173.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.31 159.82 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.457 -0.338 . . . . 25.0 110.66 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.78 125.89 29.15 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.258 -0.577 . . . . 25.0 110.351 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -107.2 109.72 21.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.862 0.839 . . . . 25.0 109.226 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.413 HD21 ' HB3' ' A' ' 15' ' ' PRO . 0.7 OUTLIER -66.29 -20.55 66.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.11 1.152 . . . . 25.0 114.11 -176.101 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.6 p -70.75 -43.65 68.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.545 0.572 . . . . 25.0 112.545 -177.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 13.9 p -104.5 -6.96 20.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.93 0.344 . . . . 25.0 111.93 -177.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 61.66 39.32 14.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.857 0.863 . . . . 25.0 110.928 -176.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.96 169.14 13.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.577 -0.738 . . . . 25.0 109.505 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.5 t -99.16 122.89 42.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -146.24 173.67 12.02 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.062 0.145 . . . . 25.0 110.676 -173.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 . . . . . 0 N--CA 1.468 0.439 0 CA-C-O 120.94 0.4 . . . . 25.0 111.569 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 114.234 1.198 . . . . 25.0 114.234 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.27 -37.32 86.82 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 125.02 1.328 . . . . 25.0 114.008 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -104.34 -1.98 26.16 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 118.437 0.562 . . . . 25.0 111.429 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -74.73 127.17 32.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.645 1.212 . . . . 25.0 108.661 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.9 -8.35 70.26 Favored Glycine 0 CA--C 1.546 2.006 0 CA-C-N 113.959 -1.473 . . . . 25.0 113.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -88.44 146.51 25.18 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 122.107 -0.643 . . . . 25.0 110.842 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.97 154.73 35.63 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.074 -1.084 . . . . 25.0 108.074 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -63.5 148.11 49.56 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 109.906 -0.405 . . . . 25.0 109.906 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.36 -169.64 25.37 Favored Glycine 0 C--O 1.211 -1.3 0 N-CA-C 110.485 -1.046 . . . . 25.0 110.485 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.5 mt -115.37 138.19 51.25 Favored 'General case' 0 CA--C 1.488 -1.44 0 O-C-N 120.502 -1.587 . . . . 25.0 110.835 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -124.99 146.45 53.55 Favored Pre-proline 0 C--O 1.218 -0.567 0 C-N-CA 125.198 1.399 . . . . 25.0 108.317 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 151.21 40.96 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 115.998 -2.201 . . . . 25.0 113.901 -171.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -87.37 138.07 32.28 Favored Pre-proline 0 CA--C 1.556 1.21 0 N-CA-C 109.1 -0.704 . . . . 25.0 109.1 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -79.41 -19.79 10.04 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 N-CA-C 116.107 1.541 . . . . 25.0 116.107 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -102.14 -42.38 6.08 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.941 -0.474 . . . . 25.0 111.816 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -106.44 162.16 13.95 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.9 -0.778 . . . . 25.0 108.9 173.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.52 -8.05 10.53 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 116.484 2.031 . . . . 25.0 116.484 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.23 10.36 31.83 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 107.849 -1.167 . . . . 25.0 107.849 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 79.7 p -121.75 167.31 13.12 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 107.867 -1.16 . . . . 25.0 107.867 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -146.72 169.95 17.98 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.099 -0.955 . . . . 25.0 109.657 -175.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.23 133.86 42.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 104.302 -2.481 . . . . 25.0 104.302 164.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -112.71 135.69 53.16 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.21 -2.145 . . . . 25.0 105.21 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -116.09 125.04 51.85 Favored 'General case' 0 C--O 1.246 0.873 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 174.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.7 124.86 16.37 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 124.243 0.965 . . . . 25.0 108.988 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 51.63 37.1 19.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.021 0.915 . . . . 25.0 111.186 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.37 7.73 64.58 Favored Glycine 0 CA--C 1.543 1.823 0 CA-C-N 115.12 -0.946 . . . . 25.0 115.156 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -108.56 150.67 27.16 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 120.805 -1.409 . . . . 25.0 108.325 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.89 133.88 36.84 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -124.76 149.23 47.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 105.715 -1.957 . . . . 25.0 105.715 171.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -129.13 105.95 8.52 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.803 -1.185 . . . . 25.0 108.09 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.97 175.23 9.73 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 112.743 0.645 . . . . 25.0 112.743 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 72.7 p -113.08 163.31 14.88 Favored 'General case' 0 C--O 1.206 -1.191 0 O-C-N 123.682 0.614 . . . . 25.0 111.708 177.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.2 88.69 37.96 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 102.136 -3.283 . . . . 25.0 102.136 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -85.09 -66.27 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.139 0 N-CA-C 120.638 3.284 . . . . 25.0 120.638 -167.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.54 117.81 25.55 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.045 -1.659 . . . . 25.0 112.703 -170.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.24 17.91 79.66 Favored Glycine 0 CA--C 1.55 2.273 0 CA-C-O 117.658 -1.634 . . . . 25.0 113.271 174.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 71.1 mt -138.13 153.19 49.26 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 114.785 1.402 . . . . 25.0 114.785 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.82 166.96 18.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -101.4 129.7 47.47 Favored 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.762 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.6 t -119.92 112.01 18.66 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 123.222 1.487 . . . . 25.0 109.895 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.02 -23.88 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.935 -1.029 . . . . 25.0 112.455 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.2 p -68.52 -29.89 68.58 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 118.964 -0.541 . . . . 25.0 111.583 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.37 -6.72 22.71 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.5 tptt 59.29 33.65 22.63 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 123.124 1.44 . . . . 25.0 108.963 -177.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 2.6 p -145.89 167.49 23.14 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 113.647 -1.615 . . . . 25.0 113.935 -170.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.1 t -85.79 136.31 33.37 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 115.15 -0.932 . . . . 25.0 109.377 175.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.9 p -131.39 170.64 14.38 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.355 -0.98 . . . . 25.0 108.355 -175.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 . . . . . 0 C--O 1.207 -1.157 0 C-N-CA 124.129 0.972 . . . . 25.0 112.423 179.697 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.415 0 CA-C-O 119.036 -0.869 . . . . 25.0 111.408 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.6 p -76.49 154.43 83.82 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 118.368 1.084 . . . . 25.0 108.428 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.99 134.65 25.84 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 117.216 -1.39 . . . . 25.0 112.956 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 p -105.06 10.51 33.98 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.632 0.604 . . . . 25.0 112.632 -174.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -54.5 -37.61 65.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.054 1.501 . . . . 25.0 115.054 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.44 3.88 15.1 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.939 0.4 . . . . 25.0 112.05 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.56 122.09 19.88 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 121.631 -0.668 . . . . 25.0 109.812 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.64 -1.45 82.84 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 121.078 -0.582 . . . . 25.0 113.643 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -82.52 143.9 30.77 Favored 'General case' 0 CA--C 1.508 -0.664 0 O-C-N 122.275 -0.544 . . . . 25.0 111.61 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.76 158.47 32.32 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 171.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -67.23 175.3 2.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.881 -0.599 . . . . 25.0 111.404 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 112.15 -178.86 19.32 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 110.73 -0.948 . . . . 25.0 110.73 -177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.424 HD22 ' CD2' ' A' ' 23' ' ' PHE . 45.9 mt -100.88 149.28 24.03 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.135 0.493 . . . . 25.0 112.192 -177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -130.07 151.68 78.76 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.378 0.671 . . . . 25.0 109.676 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.31 146.47 63.12 Favored 'Trans proline' 0 C--N 1.352 0.752 0 N-CA-C 115.11 1.158 . . . . 25.0 115.11 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -90.77 155.87 45.18 Favored Pre-proline 0 CA--C 1.544 0.749 0 CA-C-N 114.655 -1.157 . . . . 25.0 110.71 -176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -89.87 -17.94 1.58 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 N-CA-C 117.743 2.17 . . . . 25.0 117.743 -173.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -137.0 -50.42 0.65 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 117.3 2.333 . . . . 25.0 117.3 -168.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -74.41 164.08 27.01 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -171.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -65.76 -44.34 86.16 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 115.357 1.614 . . . . 25.0 115.357 -176.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 m -143.43 35.29 1.32 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.046 1.499 . . . . 25.0 115.046 -174.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 89.7 p -98.05 171.31 8.33 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 34' ' ' GLN . 14.5 p90 -147.48 172.66 13.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.471 0.653 . . . . 25.0 109.719 178.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -105.95 148.42 27.67 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 103.761 -2.681 . . . . 25.0 103.761 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -134.16 139.99 46.25 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.874 -1.899 . . . . 25.0 105.874 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -116.15 129.57 56.38 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.48 -0.933 . . . . 25.0 108.48 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.97 114.54 9.82 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.813 -1.18 . . . . 25.0 107.813 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.25 38.52 27.86 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.212 0.605 . . . . 25.0 112.168 -178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.63 1.91 73.41 Favored Glycine 0 N--CA 1.465 0.593 0 N-CA-C 115.316 0.886 . . . . 25.0 115.316 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -98.52 148.02 24.18 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 57.1 tp -100.98 132.81 46.22 Favored 'General case' 0 C--O 1.218 -0.576 0 O-C-N 123.799 0.687 . . . . 25.0 111.539 -176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -119.67 142.73 48.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.688 -1.597 . . . . 25.0 106.688 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -122.45 115.76 22.79 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.056 -2.201 . . . . 25.0 105.056 174.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.437 ' HB2' ' CE2' ' A' ' 23' ' ' PHE . 78.2 mt-30 -139.79 171.04 14.79 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.646 -0.502 . . . . 25.0 109.646 -171.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 59.9 p -110.66 155.72 22.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.41 0.893 . . . . 25.0 113.41 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.19 89.94 22.38 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 105.292 -2.114 . . . . 25.0 105.292 170.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.49 -52.33 0.05 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 0 N-CA-C 118.846 2.595 . . . . 25.0 118.846 -166.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.8 m -104.24 106.68 17.26 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.32 1.6 . . . . 25.0 115.32 -170.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.88 -4.89 14.34 Favored Glycine 0 N--CA 1.467 0.703 0 N-CA-C 114.318 0.487 . . . . 25.0 114.318 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.26 136.47 34.52 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 123.226 0.61 . . . . 25.0 110.868 -175.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.7 m -131.5 149.6 33.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 108.528 -0.916 . . . . 25.0 108.528 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -80.49 138.64 36.58 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.652 -0.499 . . . . 25.0 109.652 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -119.37 113.44 20.81 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.976 0.893 . . . . 25.0 110.086 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.8 -19.91 65.38 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.154 0.798 . . . . 25.0 113.154 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.2 p -75.18 -36.02 61.5 Favored 'General case' 0 C--O 1.219 -0.533 0 O-C-N 122.005 -0.435 . . . . 25.0 111.722 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.1 p -102.07 -7.78 21.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.635 0.976 . . . . 25.0 113.635 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 mptt 57.82 36.9 26.84 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 106.995 -1.483 . . . . 25.0 106.995 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.3 p -140.9 166.49 24.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 25.0 108.872 -174.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.1 t -113.98 137.27 51.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.333 -2.099 . . . . 25.0 105.333 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.1 t -141.0 160.23 40.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.136 0.493 . . . . 25.0 109.737 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -74.1 139.29 44.48 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.949 -1.13 . . . . 25.0 107.949 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -75.07 124.59 27.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.953 0.406 . . . . 25.0 110.417 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -103.46 -1.02 47.03 Favored Glycine 0 C--O 1.224 -0.512 0 CA-C-N 116.147 -0.479 . . . . 25.0 114.248 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.0 tt -101.67 118.61 37.3 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.026 -0.691 . . . . 25.0 111.18 -177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 73.8 t -109.83 114.2 56.72 Favored Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 108.084 -1.08 . . . . 25.0 108.084 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -91.56 21.58 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.694 1.596 . . . . 25.0 112.794 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 . . . . . 0 CA--C 1.509 -0.619 0 CA-C-O 117.265 -1.35 . . . . 25.0 109.61 -177.661 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.704 0 CA-C-O 119.598 -0.557 . . . . 25.0 111.877 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.6 p -153.79 162.89 25.59 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.59 146.43 67.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 116.698 -1.735 . . . . 25.0 113.898 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -29.49 68.68 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 116.372 1.989 . . . . 25.0 116.372 -174.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -59.85 -33.6 72.01 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.781 0.66 . . . . 25.0 112.781 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -109.61 8.04 24.79 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.165 0.507 . . . . 25.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -78.14 126.85 31.41 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 121.248 -0.908 . . . . 25.0 108.731 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.11 21.12 80.05 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.455 -0.878 . . . . 25.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -118.48 146.79 44.23 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.61 150.94 46.52 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 106.988 -1.486 . . . . 25.0 106.988 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -71.95 148.45 46.0 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 174.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -168.25 25.54 Favored Glycine 0 C--N 1.316 -0.578 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.0 mt -105.76 147.17 28.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.218 0.509 . . . . 25.0 110.86 -177.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -129.49 150.8 76.64 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.164 -0.471 . . . . 25.0 109.773 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.9 141.61 37.32 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 117.758 -1.028 . . . . 25.0 114.206 -178.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HA ' ' CE2' ' A' ' 24' ' ' TYR . 26.7 t-20 -92.04 133.32 30.58 Favored Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 104.34 -2.467 . . . . 25.0 104.34 172.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -73.5 -19.0 22.3 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 115.247 1.21 . . . . 25.0 115.247 -175.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -97.94 -35.86 10.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.306 0.574 . . . . 25.0 111.685 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.09 158.89 17.8 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 113.38 0.882 . . . . 25.0 113.38 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -100.68 -42.38 6.54 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 112.489 0.552 . . . . 25.0 112.489 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.0 m -113.27 -25.6 8.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 10.4 m -78.17 151.08 33.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.549 -0.908 . . . . 25.0 108.549 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -141.25 172.84 12.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.424 0.631 . . . . 25.0 111.756 -171.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' A' ' 16' ' ' ASN . 59.9 m-85 -100.38 151.79 21.11 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.18 -2.526 . . . . 25.0 104.18 170.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.0 t -142.7 145.7 33.64 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 108.781 -0.822 . . . . 25.0 108.781 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.3 m -126.43 136.22 52.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.01 -1.478 . . . . 25.0 107.01 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.72 117.96 7.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.693 -1.225 . . . . 25.0 107.693 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.07 34.59 20.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.064 0.946 . . . . 25.0 110.384 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.34 2.95 69.13 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 115.975 -0.557 . . . . 25.0 113.507 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -90.38 144.89 25.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.026 -1.472 . . . . 25.0 107.026 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.38 133.77 34.78 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 123.245 0.34 . . . . 25.0 110.567 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.81 139.89 52.77 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 106.634 -1.617 . . . . 25.0 106.634 169.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -123.6 115.82 22.11 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.601 -2.74 . . . . 25.0 103.601 175.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -139.93 165.72 26.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 25.0 110.817 -169.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 65.7 p -109.34 154.76 22.07 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.466 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -116.13 98.3 51.04 Favored Pre-proline 0 C--N 1.317 -0.83 0 N-CA-C 103.981 -2.6 . . . . 25.0 103.981 171.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.39 -92.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.311 0 N-CA-C 117.666 2.141 . . . . 25.0 117.666 -164.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.45 114.91 11.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.09 -1.631 . . . . 25.0 114.448 -167.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.31 8.75 85.73 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 115.558 0.983 . . . . 25.0 115.558 172.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.1 mt -122.12 154.71 37.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.146 0.498 . . . . 25.0 112.101 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.4 m -139.0 160.6 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 107.483 -1.303 . . . . 25.0 107.483 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -87.79 142.83 27.51 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.693 -0.803 . . . . 25.0 108.919 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.3 t -126.02 107.31 10.31 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.539 0.685 . . . . 25.0 110.472 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -65.33 -25.09 67.46 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.516 -0.766 . . . . 25.0 112.618 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -65.07 -29.99 70.91 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.498 0.555 . . . . 25.0 112.498 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.92 -2.09 18.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.565 0.166 . . . . 25.0 111.445 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 54.14 37.55 27.32 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.47 -0.567 . . . . 25.0 109.47 -172.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.65 167.9 21.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 25.0 109.971 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.0 t -97.4 140.3 32.07 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.418 -1.697 . . . . 25.0 106.418 175.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 80.6 p -137.89 168.44 19.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.508 0.67 . . . . 25.0 111.781 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -67.43 163.85 20.0 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.604 -1.628 . . . . 25.0 106.604 168.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -55.53 129.47 39.04 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.852 -0.795 . . . . 25.0 108.852 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.09 48.49 2.76 Favored Glycine 0 N--CA 1.464 0.509 0 N-CA-C 119.175 2.43 . . . . 25.0 119.175 -167.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.8 tt -74.11 124.57 26.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.4 t -78.08 117.05 63.63 Favored Pre-proline 0 CA--C 1.548 0.874 0 N-CA-C 109.18 -0.674 . . . . 25.0 109.18 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -91.74 9.64 2.79 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 N-CA-C 115.623 1.355 . . . . 25.0 115.623 -174.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.5 ptt85 . . . . . 0 C--O 1.249 1.033 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 -174.643 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 CA-C-O 118.595 -1.114 . . . . 25.0 111.269 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 t -67.68 142.5 96.01 Favored Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 107.214 -1.402 . . . . 25.0 107.214 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.97 154.95 53.2 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 116.448 -1.901 . . . . 25.0 112.844 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.4 p -70.42 -12.17 61.4 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 121.355 0.597 . . . . 25.0 110.795 177.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -55.69 -37.07 67.86 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.747 0.819 . . . . 25.0 112.748 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.0 t -107.18 -9.76 16.04 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.464 0.65 . . . . 25.0 112.063 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -73.33 128.16 34.7 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 121.203 -0.936 . . . . 25.0 109.066 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.52 6.2 89.36 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.827 -0.701 . . . . 25.0 112.602 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -94.92 145.71 24.73 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 109.115 -0.698 . . . . 25.0 109.115 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.91 148.19 44.58 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.937 -2.246 . . . . 25.0 104.937 172.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -66.59 146.19 54.77 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 176.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.59 -177.96 22.8 Favored Glycine 0 C--O 1.238 0.349 0 N-CA-C 110.383 -1.087 . . . . 25.0 110.383 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.9 mt -100.71 139.92 35.71 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.184 0.809 . . . . 25.0 113.184 -177.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -124.97 146.31 53.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 108.103 -1.073 . . . . 25.0 108.103 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.81 150.57 62.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 N-CA-C 114.336 0.86 . . . . 25.0 114.336 -175.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -98.98 132.81 22.91 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.208 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.45 -19.3 10.33 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.373 1.259 . . . . 25.0 115.373 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -88.53 -39.17 14.36 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -118.82 148.85 42.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.555 0.693 . . . . 25.0 112.611 -173.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -58.34 6.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.144 -0.934 . . . . 25.0 113.014 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.1 m -98.06 12.05 35.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 115.718 1.747 . . . . 25.0 115.718 -172.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 9.9 p -103.98 164.95 11.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.329 -0.548 . . . . 25.0 110.152 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -146.07 173.66 11.99 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.793 0.806 . . . . 25.0 109.853 -177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -107.9 140.44 41.02 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 103.333 -2.839 . . . . 25.0 103.333 170.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.9 t -126.24 122.39 35.4 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.817 -1.179 . . . . 25.0 107.817 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.1 m -97.87 127.7 43.99 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 105.345 -2.094 . . . . 25.0 105.345 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.38 115.04 7.7 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.498 -1.297 . . . . 25.0 107.498 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.96 34.52 22.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.784 0.834 . . . . 25.0 111.479 -176.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.45 13.23 80.11 Favored Glycine 0 C--O 1.239 0.437 0 C-N-CA 120.986 -0.626 . . . . 25.0 114.069 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 mmt-85 -106.71 146.38 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.45 109.99 22.07 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.226 0.329 . . . . 25.0 111.08 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -101.53 135.44 43.04 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.964 -1.495 . . . . 25.0 106.964 173.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -113.87 109.46 18.56 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 105.437 -2.061 . . . . 25.0 105.437 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -141.84 -179.44 6.2 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.884 -0.784 . . . . 25.0 108.884 -169.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 88.4 p -136.94 164.67 27.78 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.949 0.722 . . . . 25.0 112.949 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.32 80.94 37.44 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 175.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -82.53 -74.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.03 0 N-CA-C 117.123 1.932 . . . . 25.0 117.123 -173.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.33 115.29 16.99 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 114.004 1.112 . . . . 25.0 114.004 -172.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.56 11.62 80.29 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.871 -0.68 . . . . 25.0 114.576 173.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.3 mt -133.36 154.73 50.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.202 0.501 . . . . 25.0 110.469 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.7 m -141.46 157.69 21.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 107.96 -1.126 . . . . 25.0 107.96 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -93.79 126.4 38.95 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.728 -0.607 . . . . 25.0 109.799 177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.1 t -106.75 96.3 6.35 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.584 -0.895 . . . . 25.0 108.584 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -60.94 -27.82 68.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 25.0 111.533 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.74 -31.17 72.27 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.03 0.752 . . . . 25.0 113.03 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 2.3 p -103.21 -8.83 20.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.715 0.293 . . . . 25.0 110.879 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 tptt 64.8 23.07 12.64 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.911 0.885 . . . . 25.0 111.481 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.13 169.17 16.77 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.113 -0.949 . . . . 25.0 111.409 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.2 t -93.35 139.39 30.72 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.911 -1.885 . . . . 25.0 105.911 173.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.3 p -128.4 161.46 29.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.071 0.463 . . . . 25.0 110.537 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.4 t90 -70.51 138.68 51.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 25.0 111.919 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -78.36 132.07 37.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.78 -1.193 . . . . 25.0 107.78 175.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.33 -2.01 50.35 Favored Glycine 0 C--O 1.228 -0.223 0 N-CA-C 111.213 -0.755 . . . . 25.0 111.213 -177.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.58 127.17 30.17 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.677 -1.231 . . . . 25.0 107.677 174.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.4 t -82.43 121.72 78.49 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 -177.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -86.65 9.27 4.06 Favored 'Trans proline' 0 C--N 1.35 0.611 0 N-CA-C 115.066 1.141 . . . . 25.0 115.066 -175.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.244 0.811 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.594 0 CA-C-O 118.331 -1.261 . . . . 25.0 111.528 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 t -151.98 144.05 16.43 Favored Pre-proline 0 C--O 1.24 0.602 0 CA-C-N 118.799 1.3 . . . . 25.0 107.611 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -71.19 139.37 35.24 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 116.887 -1.609 . . . . 25.0 112.991 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.3 p -82.59 7.07 15.64 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.648 0.737 . . . . 25.0 111.037 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -47.76 -52.92 16.88 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.21 -1.93 15.94 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.834 0.679 . . . . 25.0 112.834 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -66.75 138.59 57.49 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 120.783 -1.198 . . . . 25.0 109.067 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.03 4.01 90.39 Favored Glycine 0 C--O 1.247 0.919 0 C-N-CA 121.093 -0.575 . . . . 25.0 113.181 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -113.92 154.94 26.69 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 106.075 -1.824 . . . . 25.0 106.075 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.75 151.7 46.94 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.205 -0.665 . . . . 25.0 109.205 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.49 131.68 48.91 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 158.92 -177.42 35.51 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 110.724 -0.95 . . . . 25.0 110.724 -175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.6 mt -97.32 147.82 23.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.34 . . . . 25.0 110.571 -178.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -134.21 146.65 60.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 109.082 -0.71 . . . . 25.0 109.082 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -71.35 149.44 56.84 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 117.908 -0.928 . . . . 25.0 114.32 -172.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -95.74 129.63 33.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 106.388 -1.708 . . . . 25.0 106.388 174.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -80.84 -16.71 10.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 N-CA-C 114.884 1.071 . . . . 25.0 114.884 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -92.53 -39.08 11.57 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.727 0.411 . . . . 25.0 111.219 -176.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -110.54 171.7 7.3 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.717 0.77 . . . . 25.0 109.957 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -109.63 -36.48 5.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.655 -0.702 . . . . 25.0 112.81 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 t -86.9 -26.09 24.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.743 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 55.6 p -89.39 158.77 17.63 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 121.367 -0.833 . . . . 25.0 110.698 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -139.26 169.54 17.58 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.538 0.685 . . . . 25.0 109.3 177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -103.56 150.03 24.32 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 102.914 -2.995 . . . . 25.0 102.914 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.8 t -140.13 141.2 36.1 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t -117.05 122.51 44.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.16 120.26 12.87 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.79 34.91 24.36 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.8 0.809 . . . . 25.0 112.01 -177.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.91 3.56 84.49 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.956 -0.566 . . . . 25.0 114.478 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -102.05 138.8 38.53 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.046 -1.094 . . . . 25.0 108.046 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.58 119.22 26.6 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.983 -0.747 . . . . 25.0 108.983 178.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -109.58 143.66 38.97 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.32 -1.733 . . . . 25.0 106.32 172.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -128.66 116.79 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.203 -2.147 . . . . 25.0 105.203 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -145.3 169.07 18.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.252 0.478 . . . . 25.0 110.464 -172.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 60.6 p -107.6 157.81 17.75 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 122.998 0.519 . . . . 25.0 111.64 -177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.17 88.3 31.9 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 107.391 -1.337 . . . . 25.0 107.391 173.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.77 -78.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.29 0 N-CA-C 119.486 2.841 . . . . 25.0 119.486 -170.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.08 96.39 1.06 Allowed 'General case' 0 C--O 1.242 0.66 0 N-CA-C 116.534 2.05 . . . . 25.0 116.534 -166.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.81 13.21 83.29 Favored Glycine 0 C--O 1.22 -0.749 0 CA-C-N 114.978 -1.01 . . . . 25.0 112.568 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.6 mt -107.03 137.75 44.5 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.638 0.732 . . . . 25.0 112.697 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.3 m -133.09 147.87 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.417 -0.81 . . . . 25.0 110.241 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -90.88 134.7 34.26 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.132 0.491 . . . . 25.0 110.732 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.7 t -114.02 102.68 10.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.649 1.214 . . . . 25.0 109.705 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.38 -24.18 64.75 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.688 0.996 . . . . 25.0 113.688 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 p -64.93 -35.63 81.77 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 111.689 0.255 . . . . 25.0 111.689 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.3 p -110.91 -2.54 15.99 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 113.706 1.002 . . . . 25.0 113.706 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 61.85 33.38 17.68 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.716 0.807 . . . . 25.0 111.152 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -113.52 166.72 11.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.091 0.472 . . . . 25.0 109.758 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -114.68 129.44 56.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 102.97 -2.974 . . . . 25.0 102.97 165.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.9 p -124.51 157.68 34.73 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.727 -0.471 . . . . 25.0 109.727 -174.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -79.97 145.01 32.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.596 -0.89 . . . . 25.0 108.596 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -80.37 82.1 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.501 0.667 . . . . 25.0 112.591 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -93.2 24.7 23.83 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.796 -0.638 . . . . 25.0 112.843 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.6 tt -66.72 132.77 48.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 117.207 0.503 . . . . 25.0 109.752 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -113.84 121.46 36.96 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 107.177 -1.416 . . . . 25.0 107.177 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -89.47 15.49 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 121.012 1.141 . . . . 25.0 113.662 -174.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 . . . . . 0 C--O 1.246 0.908 0 N-CA-C 108.682 -0.859 . . . . 25.0 108.682 -178.391 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 118.993 -0.893 . . . . 25.0 111.291 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.7 m -81.01 146.16 58.48 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 118.203 1.002 . . . . 25.0 110.323 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.26 142.47 41.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 116.788 -1.675 . . . . 25.0 111.85 176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.4 p -81.39 -10.79 59.46 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 120.873 0.368 . . . . 25.0 111.956 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 31' ' ' LEU . 72.3 t80 -57.83 -31.08 66.29 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.082 1.142 . . . . 25.0 114.082 -177.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 m -111.69 2.0 17.0 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.654 0.613 . . . . 25.0 112.654 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -78.95 134.14 36.85 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.878 -1.527 . . . . 25.0 106.878 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.62 4.29 89.14 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.767 -0.73 . . . . 25.0 112.008 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -113.32 148.96 34.65 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 176.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.27 150.79 43.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.048 -1.834 . . . . 25.0 106.048 173.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.06 150.02 48.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.796 -1.187 . . . . 25.0 107.796 176.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.44 -171.44 24.3 Favored Glycine 0 C--O 1.237 0.294 0 N-CA-C 110.241 -1.143 . . . . 25.0 110.241 -176.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.414 HD22 ' CD2' ' A' ' 23' ' ' PHE . 29.7 mt -105.94 141.0 38.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.558 0.694 . . . . 25.0 112.464 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -124.4 150.3 63.93 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -67.75 147.4 75.35 Favored 'Trans proline' 0 C--N 1.35 0.625 0 N-CA-C 114.325 0.856 . . . . 25.0 114.325 -176.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 p-10 -92.04 154.96 43.41 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 114.86 -1.064 . . . . 25.0 111.175 -177.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.0 -33.24 19.97 Favored 'Trans proline' 0 CA--C 1.545 1.049 0 N-CA-C 116.71 1.773 . . . . 25.0 116.71 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -162.3 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 113.698 0.999 . . . . 25.0 113.698 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 36.25 -105.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.718 1.377 . . . . 25.0 114.718 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 -61.86 0.12 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.088 0.471 . . . . 25.0 111.545 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.7 p -150.94 37.94 0.65 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 122.169 0.985 . . . . 25.0 110.243 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 78.0 p -98.8 168.91 9.83 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.478 -1.237 . . . . 25.0 109.662 -179.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.414 ' CD2' HD22 ' A' ' 13' ' ' LEU . 7.9 p90 -145.68 172.73 12.85 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.848 -0.797 . . . . 25.0 108.848 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -102.76 137.17 41.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 102.86 -3.015 . . . . 25.0 102.86 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.1 t -126.72 135.47 51.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.8 m -113.69 127.75 56.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.545 -1.65 . . . . 25.0 106.545 174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.48 122.12 12.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.52 31.59 17.39 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 124.07 0.948 . . . . 25.0 110.969 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.37 11.83 79.86 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.864 -0.607 . . . . 25.0 114.231 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -108.9 151.1 26.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.174 -1.047 . . . . 25.0 108.174 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 5' ' ' PHE . 49.5 tp -92.29 129.51 38.21 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.317 0.385 . . . . 25.0 111.907 -178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -122.69 134.11 54.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.342 -2.096 . . . . 25.0 105.342 167.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -113.95 112.69 23.72 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 104.852 -2.277 . . . . 25.0 104.852 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -140.44 173.44 11.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.577 -0.527 . . . . 25.0 109.577 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 84.5 p -122.51 159.51 27.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.737 1.014 . . . . 25.0 113.737 -177.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.89 72.11 62.49 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 107.444 -1.317 . . . . 25.0 107.444 177.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -82.88 -60.67 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.753 0 N-CA-C 117.62 2.123 . . . . 25.0 117.62 -170.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 p -80.63 111.04 16.69 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.938 1.088 . . . . 25.0 113.938 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.33 14.91 76.98 Favored Glycine 0 C--O 1.221 -0.684 0 C-N-CA 120.706 -0.759 . . . . 25.0 113.795 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.7 mt -124.93 149.57 47.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.782 0.791 . . . . 25.0 112.225 -171.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.9 m -139.16 148.77 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 122.839 0.456 . . . . 25.0 109.87 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.4 t80 -93.41 131.41 38.62 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.979 -0.451 . . . . 25.0 110.003 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.6 t -115.97 109.18 17.21 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.628 -0.879 . . . . 25.0 108.628 176.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -65.69 -28.27 68.95 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.367 0.506 . . . . 25.0 112.367 -178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.1 p -70.62 -34.57 72.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.687 0.28 . . . . 25.0 110.494 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.7 t -79.38 -21.85 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.655 -0.498 . . . . 25.0 109.655 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 59.31 29.73 19.33 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.412 -0.959 . . . . 25.0 108.412 -171.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.9 p -144.55 168.46 20.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.114 -0.948 . . . . 25.0 110.126 -174.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.1 t -105.23 134.77 47.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.714 -1.958 . . . . 25.0 105.714 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.8 p -121.03 159.9 24.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.935 0.398 . . . . 25.0 110.056 -176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -72.9 136.17 45.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.799 -1.556 . . . . 25.0 106.799 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -73.07 149.4 43.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.668 -0.493 . . . . 25.0 109.668 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.66 14.46 61.34 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 121.051 -0.595 . . . . 25.0 112.357 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.5 tp -62.36 122.92 16.9 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.297 -0.631 . . . . 25.0 109.297 176.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.2 t -84.28 122.79 75.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 107.88 -1.156 . . . . 25.0 107.88 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -74.75 -13.86 21.91 Favored 'Trans proline' 0 C--N 1.351 0.687 0 N-CA-C 114.828 1.049 . . . . 25.0 114.828 -177.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 124.457 1.103 . . . . 25.0 110.086 -177.729 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 CA-C-O 118.547 -1.141 . . . . 25.0 111.42 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.6 t -150.4 141.88 15.14 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 107.165 -1.42 . . . . 25.0 107.165 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -74.36 165.03 32.73 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 116.953 -1.564 . . . . 25.0 112.056 178.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p -80.87 1.92 28.74 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.329 0.585 . . . . 25.0 111.298 176.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.41 ' CD1' HD13 ' A' ' 31' ' ' LEU . 60.0 t80 -57.16 -44.6 83.62 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.855 1.058 . . . . 25.0 113.855 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.3 m -100.91 1.44 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.905 0.383 . . . . 25.0 111.931 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.47 134.64 39.47 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 107.604 -1.258 . . . . 25.0 107.604 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.17 13.72 81.54 Favored Glycine 0 C--O 1.229 -0.218 0 C-N-CA 120.988 -0.625 . . . . 25.0 112.482 -177.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -118.62 155.59 30.7 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.915 -1.143 . . . . 25.0 107.915 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.85 155.87 28.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 105.586 -2.005 . . . . 25.0 105.586 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -70.23 148.74 48.23 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.69 -1.226 . . . . 25.0 107.69 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.81 -173.39 24.05 Favored Glycine 0 C--O 1.238 0.394 0 N-CA-C 110.037 -1.225 . . . . 25.0 110.037 -176.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 23' ' ' PHE . 46.7 mt -96.49 153.7 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.611 0.706 . . . . 25.0 110.551 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -135.46 149.02 68.33 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 107.925 -1.139 . . . . 25.0 107.925 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -67.11 144.31 68.83 Favored 'Trans proline' 0 C--N 1.355 0.904 0 N-CA-C 115.632 1.359 . . . . 25.0 115.632 -173.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 p-10 -83.73 154.22 64.83 Favored Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.83 -24.21 2.3 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 N-CA-C 118.442 2.439 . . . . 25.0 118.442 -172.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -140.48 -36.45 0.48 Allowed 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.641 2.089 . . . . 25.0 116.641 -170.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 19.6 mp0 -76.91 176.71 8.33 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.711 -0.677 . . . . 25.0 111.341 -172.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -69.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.744 1.016 . . . . 25.0 113.744 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -113.61 16.59 18.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.054 1.502 . . . . 25.0 115.054 -172.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.4 p -79.93 172.01 14.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.363 -0.976 . . . . 25.0 108.363 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.408 ' CD2' HD22 ' A' ' 13' ' ' LEU . 8.9 p90 -156.61 170.73 21.72 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.37 0.605 . . . . 25.0 110.332 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -103.66 150.03 24.39 Favored 'General case' 0 CA--C 1.502 -0.866 0 N-CA-C 103.104 -2.924 . . . . 25.0 103.104 170.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.6 t -133.99 133.07 40.87 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.2 m -107.85 127.35 53.64 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 105.712 -1.958 . . . . 25.0 105.712 174.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.98 121.55 14.18 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.104 -1.443 . . . . 25.0 107.104 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.09 31.88 19.02 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.875 0.87 . . . . 25.0 110.034 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.54 9.55 69.26 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.885 -0.598 . . . . 25.0 114.533 -178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -103.56 150.01 24.35 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.064 -1.087 . . . . 25.0 108.064 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.41 HD13 ' CD1' ' A' ' 5' ' ' PHE . 54.1 tp -91.3 130.01 37.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.39 0.515 . . . . 25.0 112.39 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -122.86 134.74 54.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.74 -1.948 . . . . 25.0 105.74 167.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -113.94 123.31 49.44 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 104.959 -2.237 . . . . 25.0 104.959 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -138.57 161.31 37.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.959 0.409 . . . . 25.0 111.19 -174.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.0 p -110.43 141.22 43.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 177.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -98.99 127.81 33.99 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 102.909 -2.997 . . . . 25.0 102.909 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.74 -106.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 N-CA-C 116.052 1.52 . . . . 25.0 116.052 -166.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.2 t -105.58 152.82 22.6 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.448 -0.783 . . . . 25.0 112.372 -174.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.62 2.4 64.02 Favored Glycine 0 C--O 1.235 0.206 0 N-CA-C 114.767 0.667 . . . . 25.0 114.767 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 51' ' ' TRP . 48.2 mt -131.58 155.28 47.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 25.0 111.279 -174.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.85 157.28 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 107.643 -1.244 . . . . 25.0 107.643 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -82.74 130.29 35.1 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.2 t -115.94 109.79 18.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.512 0.672 . . . . 25.0 109.631 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.49 -25.66 68.09 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.324 0.861 . . . . 25.0 113.324 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.4 p -66.5 -38.11 86.53 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.922 0.712 . . . . 25.0 112.922 -175.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.1 p -104.02 -8.23 19.72 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.391 -0.596 . . . . 25.0 109.391 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.4 tptt 63.29 33.01 14.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.108 -0.951 . . . . 25.0 112.044 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 163.84 20.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.424 -0.807 . . . . 25.0 110.271 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -86.86 125.13 33.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 102.898 -3.001 . . . . 25.0 102.898 165.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.2 p -121.24 161.75 21.41 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.401 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.9 t90 -65.59 136.88 56.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.094 -0.957 . . . . 25.0 110.849 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -83.58 30.09 0.5 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.338 0.866 . . . . 25.0 113.338 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 55.47 45.26 84.55 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 116.002 1.161 . . . . 25.0 116.002 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 tt -63.65 126.89 29.04 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.002 -0.705 . . . . 25.0 109.571 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.61 118.72 71.71 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 107.52 -1.289 . . . . 25.0 107.52 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.93 -5.49 16.41 Favored 'Trans proline' 0 C--N 1.353 0.789 0 N-CA-C 114.765 1.025 . . . . 25.0 114.765 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 . . . . . 0 C--O 1.248 0.998 0 CA-C-O 116.716 -1.611 . . . . 25.0 110.41 -178.801 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 118.858 -0.968 . . . . 25.0 111.399 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t -150.64 147.14 20.61 Favored Pre-proline 0 N--CA 1.468 0.445 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.1 146.55 58.45 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 115.997 -2.202 . . . . 25.0 112.283 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.7 p -106.05 6.5 31.2 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.927 -0.579 . . . . 25.0 110.789 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.26 -35.84 60.48 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.756 1.762 . . . . 25.0 115.756 -174.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.7 t -105.11 -6.61 19.76 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.121 0.486 . . . . 25.0 111.244 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -71.83 127.45 32.59 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.264 -0.898 . . . . 25.0 109.138 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.55 5.39 88.46 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.977 -0.63 . . . . 25.0 113.28 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -107.68 145.51 33.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 117.475 0.637 . . . . 25.0 110.11 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.15 153.71 41.49 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.145 -1.057 . . . . 25.0 108.145 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -67.21 160.45 26.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.079 -0.51 . . . . 25.0 109.721 177.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.54 16.5 Favored Glycine 0 C--O 1.235 0.158 0 N-CA-C 110.601 -0.999 . . . . 25.0 110.601 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 mt -96.38 147.27 23.99 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -176.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -129.77 151.72 78.61 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 106.201 -1.778 . . . . 25.0 106.201 178.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.59 144.44 60.52 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 117.799 -1.001 . . . . 25.0 113.815 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -80.99 158.08 70.58 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.875 0.87 . . . . 25.0 112.598 -175.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -86.52 -23.67 1.72 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 N-CA-C 119.093 2.69 . . . . 25.0 119.093 -172.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -136.29 -44.72 0.62 Allowed 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 115.588 1.699 . . . . 25.0 115.588 -170.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -71.24 166.37 21.69 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.69 -1.141 . . . . 25.0 111.326 -173.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.9 tpt85 -77.2 -39.51 48.45 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.696 0.998 . . . . 25.0 113.696 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -128.39 3.73 5.68 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 118.95 2.944 . . . . 25.0 118.95 -167.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.8 p -85.89 178.07 7.41 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.301 -1.5 . . . . 25.0 109.265 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -143.14 170.98 14.71 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.456 0.646 . . . . 25.0 109.792 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -101.42 144.52 30.11 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 101.727 -3.434 . . . . 25.0 101.727 167.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.2 t -135.56 136.67 41.31 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 107.659 -1.237 . . . . 25.0 107.659 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.97 129.9 56.03 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 105.168 -2.16 . . . . 25.0 105.168 174.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.78 117.62 8.75 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.223 -1.399 . . . . 25.0 107.223 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.62 33.96 22.25 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.74 0.816 . . . . 25.0 110.815 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.75 5.49 74.52 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.299 -0.477 . . . . 25.0 114.179 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -100.87 144.59 29.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.243 -1.021 . . . . 25.0 108.243 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -91.31 128.67 37.23 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.289 -0.414 . . . . 25.0 111.61 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -121.27 133.74 55.15 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 169.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -116.21 107.81 15.34 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 104.88 -2.267 . . . . 25.0 104.88 175.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -146.5 172.84 12.95 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 120.469 0.176 . . . . 25.0 110.971 -169.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.5 p -114.17 164.13 14.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 171.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.55 127.64 55.82 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 106.782 -1.562 . . . . 25.0 106.782 178.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -66.33 -52.05 0.93 Allowed 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 116.489 -1.874 . . . . 25.0 116.335 -172.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.78 131.23 53.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.984 0.735 . . . . 25.0 112.984 -178.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.34 22.75 78.56 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.213 -0.994 . . . . 25.0 115.191 168.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.44 118.98 3.67 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -149.36 157.27 6.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 102.755 -3.054 . . . . 25.0 102.755 160.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -119.92 132.3 55.49 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.8 t -116.34 111.89 20.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.925 -0.768 . . . . 25.0 108.925 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -62.75 -30.42 71.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.596 -0.729 . . . . 25.0 111.991 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.3 p -67.78 -33.09 74.14 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 112.655 0.613 . . . . 25.0 112.655 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.1 -5.61 43.85 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.694 -0.484 . . . . 25.0 109.694 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.95 29.09 17.11 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.582 0.753 . . . . 25.0 109.671 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -141.88 166.57 24.35 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 113.663 0.986 . . . . 25.0 113.663 -167.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.8 t -79.91 138.48 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.685 -1.598 . . . . 25.0 106.685 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.3 p -124.33 167.98 13.61 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.939 -1.504 . . . . 25.0 106.939 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -95.67 145.05 25.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.07 0.462 . . . . 25.0 109.97 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -80.44 96.69 6.81 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.896 0.702 . . . . 25.0 112.896 -174.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.31 3.89 90.38 Favored Glycine 0 C--O 1.228 -0.253 0 CA-C-N 115.81 -0.632 . . . . 25.0 114.532 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.26 156.72 46.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 122.35 -0.5 . . . . 25.0 110.342 -178.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 91.3 t -105.88 111.34 64.57 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 105.53 -2.026 . . . . 25.0 105.53 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -89.69 16.47 1.74 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 120.587 0.858 . . . . 25.0 113.389 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 . . . . . 0 C--O 1.241 0.607 0 CA-C-O 117.984 -1.007 . . . . 25.0 109.739 -177.512 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 118.064 -1.409 . . . . 25.0 111.19 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 t 52.18 70.73 1.74 Allowed Pre-proline 0 N--CA 1.479 1.013 0 N-CA-C 113.876 1.065 . . . . 25.0 113.876 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -70.52 151.97 65.06 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 116.597 -1.802 . . . . 25.0 112.943 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.2 p -77.58 2.94 14.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.283 0.564 . . . . 25.0 111.904 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -56.94 -43.67 81.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.8 t -108.67 -16.41 14.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.386 0.613 . . . . 25.0 111.316 -178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -67.45 127.72 33.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 O-C-N 120.909 -1.119 . . . . 25.0 110.984 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.76 20.25 74.13 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 120.963 -0.637 . . . . 25.0 112.849 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -118.07 161.89 19.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.22 145.49 39.73 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 106.134 -1.802 . . . . 25.0 106.134 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -66.87 146.08 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.227 -1.397 . . . . 25.0 107.227 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.05 -178.36 25.69 Favored Glycine 0 C--N 1.322 -0.239 0 N-CA-C 110.993 -0.843 . . . . 25.0 110.993 -176.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.426 HD22 ' CD2' ' A' ' 23' ' ' PHE . 26.2 mt -96.46 144.78 26.25 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.213 0.53 . . . . 25.0 112.023 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -131.7 154.28 81.76 Favored Pre-proline 0 C--N 1.322 -0.62 0 N-CA-C 108.638 -0.875 . . . . 25.0 108.638 -177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.11 137.59 37.74 Favored 'Trans proline' 0 C--N 1.351 0.663 0 N-CA-C 115.802 1.424 . . . . 25.0 115.802 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -83.51 159.2 61.88 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 125.121 1.368 . . . . 25.0 111.476 -178.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.58 -24.8 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 N-CA-C 118.408 2.426 . . . . 25.0 118.408 -172.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -147.42 -44.41 0.17 Allowed 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.779 2.14 . . . . 25.0 116.779 -171.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -68.72 162.49 26.04 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 113.488 0.921 . . . . 25.0 113.488 -168.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -82.61 -34.54 27.59 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.233 0.827 . . . . 25.0 113.233 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 48.1 t -107.91 -21.71 12.73 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.426 1.639 . . . . 25.0 115.426 -170.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 80.5 p -82.56 164.03 21.11 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.342 -0.848 . . . . 25.0 112.706 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.426 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.2 p90 -142.38 174.27 10.77 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -104.64 146.45 28.91 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 102.75 -3.056 . . . . 25.0 102.75 168.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.3 t -132.46 134.46 45.1 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.23 -1.396 . . . . 25.0 107.23 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.1 t -110.96 119.93 40.71 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 102.071 -3.307 . . . . 25.0 102.071 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.77 121.67 11.31 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.295 -0.631 . . . . 25.0 109.295 -175.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.36 31.23 18.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.057 0.943 . . . . 25.0 110.99 -176.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.55 8.43 84.06 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.149 -0.548 . . . . 25.0 113.689 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.72 151.43 30.26 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.642 -0.503 . . . . 25.0 109.642 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.29 132.27 34.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.976 -0.556 . . . . 25.0 111.343 -177.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -128.67 139.1 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.264 -1.754 . . . . 25.0 106.264 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -121.23 111.38 17.31 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.296 -2.113 . . . . 25.0 105.296 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.62 176.4 8.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.792 -0.818 . . . . 25.0 108.792 -171.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 75.5 p -124.28 156.38 37.02 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 115.477 1.658 . . . . 25.0 115.477 -174.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -112.27 98.0 41.5 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.191 -1.411 . . . . 25.0 107.191 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.44 -91.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.302 0 N-CA-C 117.146 1.941 . . . . 25.0 117.146 -172.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -77.34 115.79 17.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 115.197 1.555 . . . . 25.0 115.197 -171.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 2.68 55.53 Favored Glycine 0 C--O 1.227 -0.312 0 N-CA-C 115.332 0.893 . . . . 25.0 115.332 172.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -105.1 134.66 47.83 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.108 0.454 . . . . 25.0 110.064 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -126.5 146.1 32.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -81.9 132.64 35.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -118.89 109.33 15.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.014 0.912 . . . . 25.0 108.634 176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.99 -26.7 68.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.46 -0.791 . . . . 25.0 112.88 -176.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p -67.8 -29.76 69.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.542 0.571 . . . . 25.0 112.542 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 32.0 p -103.68 -5.3 22.72 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 121.425 -0.11 . . . . 25.0 111.225 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 54.66 39.44 31.26 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -174.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.6 p -146.88 168.77 20.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.57 -0.741 . . . . 25.0 110.299 -172.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.43 137.98 38.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.227 -1.768 . . . . 25.0 106.227 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -124.46 149.96 46.24 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.742 0.306 . . . . 25.0 110.201 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -72.98 135.01 44.92 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 107.846 -1.168 . . . . 25.0 107.846 174.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -84.66 67.59 10.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.144 0.497 . . . . 25.0 110.458 177.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.1 56.05 0.72 Allowed Glycine 0 C--O 1.223 -0.538 0 N-CA-C 110.996 -0.842 . . . . 25.0 110.996 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.11 131.42 49.47 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.86 0.362 . . . . 25.0 111.396 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -121.23 126.5 26.54 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 106.331 -1.729 . . . . 25.0 106.331 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -88.46 11.86 2.96 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 N-CA-C 114.892 1.074 . . . . 25.0 114.892 -174.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.243 0.744 0 N-CA-C 108.229 -1.026 . . . . 25.0 108.229 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.141 0 CA-C-O 119.185 -0.786 . . . . 25.0 111.507 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.2 m -136.51 153.15 75.89 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 107.012 -1.477 . . . . 25.0 107.012 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.32 144.69 46.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 116.011 -2.192 . . . . 25.0 112.022 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.9 p -75.13 -12.58 60.34 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-O 121.324 0.583 . . . . 25.0 110.502 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -55.69 -29.4 59.34 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.997 1.11 . . . . 25.0 113.997 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.2 t -112.31 -10.56 13.79 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.204 0.526 . . . . 25.0 112.396 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -72.68 126.68 30.47 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.327 -0.858 . . . . 25.0 109.376 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.04 2.1 84.04 Favored Glycine 0 C--O 1.225 -0.451 0 C-N-CA 121.302 -0.475 . . . . 25.0 113.004 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -101.03 147.56 26.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 O-C-N 122.264 -0.551 . . . . 25.0 111.839 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.13 161.47 26.87 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.872 -1.159 . . . . 25.0 107.872 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -72.32 179.8 3.25 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.228 0.537 . . . . 25.0 110.803 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.28 -176.63 24.55 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 112.046 -0.422 . . . . 25.0 112.046 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.7 mt -96.76 145.76 25.52 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.006 0.432 . . . . 25.0 111.834 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.67 147.2 57.56 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 108.997 -0.742 . . . . 25.0 108.997 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.76 155.62 65.44 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 114.661 0.985 . . . . 25.0 114.661 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -95.24 153.81 39.61 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.129 0.972 . . . . 25.0 110.903 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.05 -26.57 10.7 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 117.149 -1.434 . . . . 25.0 115.711 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -163.76 -78.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.232 0.469 . . . . 25.0 111.258 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 38.62 -129.22 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.142 0.977 . . . . 25.0 112.297 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -136.43 -55.93 0.75 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.486 0.714 . . . . 25.0 110.152 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 m -156.56 47.4 0.45 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.161 0.43 . . . . 25.0 112.161 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -133.13 169.7 16.48 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 115.904 -0.589 . . . . 25.0 111.469 -174.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -153.64 174.34 14.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.978 -1.489 . . . . 25.0 106.978 -175.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -105.42 160.83 14.84 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.57 141.51 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.521 -0.918 . . . . 25.0 108.521 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.6 127.24 55.08 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 128.33 14.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.062 -1.459 . . . . 25.0 107.062 178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.34 30.67 10.58 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.095 0.776 . . . . 25.0 113.095 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.91 9.14 79.31 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.427 -0.416 . . . . 25.0 113.922 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -110.4 147.4 34.09 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.479 -0.934 . . . . 25.0 108.479 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -89.82 130.27 36.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.308 -0.86 . . . . 25.0 110.381 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -120.75 149.54 42.38 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 104.029 -2.582 . . . . 25.0 104.029 168.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -118.64 137.8 53.03 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 103.051 -2.944 . . . . 25.0 103.051 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -133.61 168.45 18.66 Favored 'General case' 0 CA--C 1.503 -0.863 0 O-C-N 123.293 0.37 . . . . 25.0 110.968 -173.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.0 p -136.9 159.1 42.86 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 102.145 -3.279 . . . . 25.0 102.145 170.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.1 m -123.17 78.54 52.26 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 104.091 -2.559 . . . . 25.0 104.091 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.79 -47.46 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 116.871 -1.619 . . . . 25.0 115.825 -167.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -100.95 116.21 32.26 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.055 1.131 . . . . 25.0 114.055 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.54 -11.44 6.99 Favored Glycine 0 N--CA 1.463 0.452 0 N-CA-C 118.791 2.277 . . . . 25.0 118.791 170.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.7 mt -120.79 152.66 38.08 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.44 1.12 . . . . 25.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.8 m -136.63 144.33 32.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.634 -0.876 . . . . 25.0 108.634 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.415 ' HA ' ' HA ' ' A' ' 49' ' ' CYS . 19.2 t80 -74.68 127.15 32.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.0 0.429 . . . . 25.0 110.927 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -112.88 111.49 22.29 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 122.033 0.92 . . . . 25.0 108.801 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -63.78 -21.97 66.68 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.781 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.2 p -67.95 -34.92 77.51 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.491 0.552 . . . . 25.0 112.491 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 3.1 p -104.28 -9.78 18.32 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 121.109 -0.236 . . . . 25.0 111.441 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 63.11 33.98 14.07 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.899 0.88 . . . . 25.0 110.591 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -142.83 166.68 23.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.642 -0.708 . . . . 25.0 109.26 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 42' ' ' PHE . 30.7 m -86.8 146.83 26.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 106.735 -1.579 . . . . 25.0 106.735 169.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.17 160.7 27.27 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -67.76 130.18 42.21 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -82.01 103.27 11.53 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.937 1.088 . . . . 25.0 113.937 -173.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.4 -1.07 86.74 Favored Glycine 0 N--CA 1.459 0.183 0 N-CA-C 115.272 0.869 . . . . 25.0 115.272 172.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.02 155.32 27.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.079 -0.66 . . . . 25.0 110.413 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.1 t -85.14 125.93 68.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -88.68 16.1 1.92 Allowed 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.296 1.331 . . . . 25.0 113.969 -177.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 . . . . . 0 C--O 1.248 1.013 0 N-CA-C 108.54 -0.911 . . . . 25.0 108.54 -177.581 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.517 0 CA-C-O 119.06 -0.855 . . . . 25.0 111.35 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -71.5 147.91 92.8 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 107.764 -1.198 . . . . 25.0 107.764 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.24 124.8 11.23 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 116.512 -1.859 . . . . 25.0 113.605 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.6 p -86.24 30.79 0.67 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.33 0.863 . . . . 25.0 113.33 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -62.01 -41.47 98.1 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.747 -0.596 . . . . 25.0 112.465 -177.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.4 -12.0 9.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.576 0.703 . . . . 25.0 111.027 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.65 128.66 37.25 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 121.445 -0.785 . . . . 25.0 110.236 -177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.97 16.41 80.7 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 121.058 -0.592 . . . . 25.0 112.851 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -114.15 148.42 37.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 117.007 0.403 . . . . 25.0 110.647 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.15 150.81 47.11 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.472 -0.936 . . . . 25.0 108.472 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -68.77 164.66 21.31 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.357 0.598 . . . . 25.0 110.677 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.92 -175.13 16.0 Favored Glycine 0 CA--C 1.516 0.113 0 N-CA-C 110.306 -1.118 . . . . 25.0 110.306 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 29.1 mt -93.59 152.06 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.699 1.0 . . . . 25.0 113.699 -176.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -133.68 148.79 69.95 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.98 145.5 35.82 Favored 'Trans proline' 0 C--N 1.349 0.555 0 N-CA-C 114.281 0.839 . . . . 25.0 114.281 -174.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -102.56 120.34 53.3 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 110.123 -0.325 . . . . 25.0 110.123 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.04 -18.1 14.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 116.31 -1.993 . . . . 25.0 113.808 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -70.34 -52.21 24.37 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 111.977 0.362 . . . . 25.0 111.977 -175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.81 141.07 52.17 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.26 -18.75 44.89 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.338 1.066 . . . . 25.0 108.326 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -77.71 -0.87 28.51 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.292 -1.777 . . . . 25.0 113.323 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 60.7 p -137.65 170.09 16.67 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.578 0.704 . . . . 25.0 112.172 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -143.52 172.56 12.62 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 25.0 108.741 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -107.79 152.8 23.88 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 102.959 -2.978 . . . . 25.0 102.959 171.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.7 t -140.02 142.75 36.22 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.137 -1.06 . . . . 25.0 108.137 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 m -112.49 128.91 56.47 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 104.682 -2.34 . . . . 25.0 104.682 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.55 113.72 6.94 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 107.234 -1.395 . . . . 25.0 107.234 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.35 34.86 24.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.786 0.834 . . . . 25.0 110.189 -174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.65 -1.49 57.7 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.691 0.636 . . . . 25.0 114.691 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -88.82 150.14 23.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.341 -0.985 . . . . 25.0 108.341 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.85 124.63 37.98 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 123.597 0.56 . . . . 25.0 109.821 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -118.99 136.5 54.07 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.275 -1.38 . . . . 25.0 107.275 172.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -117.28 118.36 32.05 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 175.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -142.06 157.92 44.35 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.158 0.435 . . . . 25.0 110.838 -175.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 48.8 p -94.1 162.44 13.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.554 . . . . 25.0 109.886 177.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 44.9 t -114.62 122.63 33.59 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 107.258 -1.386 . . . . 25.0 107.258 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.62 -41.49 0.25 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 115.977 -2.215 . . . . 25.0 117.584 -173.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.1 m -103.66 117.32 34.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 115.653 1.723 . . . . 25.0 115.653 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.17 21.39 79.25 Favored Glycine 0 C--O 1.21 -1.404 0 C-N-CA 120.499 -0.857 . . . . 25.0 113.322 171.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -46.55 104.73 0.05 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 119.851 3.278 . . . . 25.0 119.851 -162.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -149.06 162.69 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 104.507 -2.405 . . . . 25.0 104.507 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -112.22 131.06 55.7 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.774 -0.579 . . . . 25.0 110.802 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 t -107.07 113.72 27.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.474 -0.565 . . . . 25.0 109.474 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.71 -35.32 79.36 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.657 0.614 . . . . 25.0 112.657 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.0 p -69.1 -33.14 73.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 120.769 0.319 . . . . 25.0 111.067 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 46.1 t -81.86 -22.13 37.13 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.672 -0.492 . . . . 25.0 109.672 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.2 tptt 59.97 26.86 16.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.684 -1.228 . . . . 25.0 107.684 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.0 p -142.03 167.86 21.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.273 -174.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.47 138.06 35.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.0 p -131.39 168.01 18.32 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.905 -0.776 . . . . 25.0 108.905 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 53.6 m0 -75.64 148.48 38.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.26 -0.645 . . . . 25.0 109.26 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.2 93.51 2.83 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.59 11.75 82.62 Favored Glycine 0 C--O 1.224 -0.491 0 N-CA-C 115.633 1.013 . . . . 25.0 115.633 174.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.7 tp -132.18 136.82 47.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.429 0.615 . . . . 25.0 110.039 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 44.0 t -122.21 125.66 26.51 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -76.72 -23.08 11.37 Favored 'Trans proline' 0 C--N 1.351 0.698 0 N-CA-C 117.389 2.034 . . . . 25.0 117.389 -173.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 . . . . . 0 C--O 1.244 0.772 0 N-CA-C 106.417 -1.697 . . . . 25.0 106.417 -176.966 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.088 0 CA-C-O 118.728 -1.04 . . . . 25.0 111.382 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -137.24 152.83 74.23 Favored Pre-proline 0 N--CA 1.468 0.452 0 N-CA-C 107.774 -1.195 . . . . 25.0 107.774 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.21 136.23 28.76 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 117.13 -1.446 . . . . 25.0 112.689 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.6 p -81.91 -2.02 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.593 0.711 . . . . 25.0 111.824 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.401 ' CD1' HD22 ' A' ' 31' ' ' LEU . 81.8 t80 -63.01 -41.16 99.49 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.8 t -95.99 -17.26 21.13 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.602 0.715 . . . . 25.0 111.007 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -68.16 132.39 47.1 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.069 -1.019 . . . . 25.0 109.071 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.44 12.81 79.83 Favored Glycine 0 C--O 1.226 -0.389 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.303 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -122.27 163.23 20.02 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.235 -1.395 . . . . 25.0 107.235 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.4 32.88 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 106.313 -1.736 . . . . 25.0 106.313 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.44 148.12 49.99 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.127 -1.064 . . . . 25.0 108.127 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.12 -177.28 23.66 Favored Glycine 0 C--O 1.237 0.315 0 N-CA-C 111.23 -0.748 . . . . 25.0 111.23 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.6 mt -96.46 139.75 32.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.146 0.498 . . . . 25.0 110.777 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -125.11 152.85 71.27 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 107.997 -1.112 . . . . 25.0 107.997 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.42 147.42 71.3 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 118.004 -0.864 . . . . 25.0 113.791 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -86.49 159.46 52.86 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 115.145 -0.934 . . . . 25.0 111.585 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -83.86 -20.19 4.6 Favored 'Trans proline' 0 C--N 1.35 0.653 0 N-CA-C 118.032 2.282 . . . . 25.0 118.032 -172.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -146.01 -47.06 0.2 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.171 2.285 . . . . 25.0 117.171 -169.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -72.24 169.99 15.03 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.243 -0.435 . . . . 25.0 111.056 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -81.97 -50.49 9.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.192 1.182 . . . . 25.0 114.192 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 m -112.57 18.59 18.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 116.13 1.9 . . . . 25.0 116.13 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 86.9 p -102.07 165.46 11.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.173 0.442 . . . . 25.0 110.407 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -142.16 174.5 10.55 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.725 -0.843 . . . . 25.0 108.725 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -105.42 136.21 45.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 103.266 -2.865 . . . . 25.0 103.266 169.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -121.45 120.24 34.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.799 -1.185 . . . . 25.0 107.799 177.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.9 t -103.74 121.39 42.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 105.146 -2.168 . . . . 25.0 105.146 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -148.33 118.59 7.31 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.886 -0.413 . . . . 25.0 109.886 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.38 35.92 24.19 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.714 0.806 . . . . 25.0 112.335 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.01 3.38 84.58 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.071 -0.585 . . . . 25.0 113.639 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -104.74 150.8 24.45 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.053 -1.091 . . . . 25.0 108.053 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.401 HD22 ' CD1' ' A' ' 5' ' ' PHE . 62.7 tp -107.81 132.81 53.01 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.006 -0.739 . . . . 25.0 109.006 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -123.18 134.99 54.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 104.934 -2.247 . . . . 25.0 104.934 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -113.88 108.12 16.63 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 104.932 -2.247 . . . . 25.0 104.932 174.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -135.68 177.06 8.12 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 79.8 p -126.08 168.6 13.76 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -176.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 81.2 m -100.19 98.23 7.37 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 105.739 -1.948 . . . . 25.0 105.739 171.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -84.98 -96.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 0 N-CA-C 116.002 1.501 . . . . 25.0 116.002 -172.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -73.78 114.89 12.57 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 121.187 -0.945 . . . . 25.0 113.402 -172.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.18 11.54 75.32 Favored Glycine 0 C--O 1.229 -0.209 0 CA-C-N 115.681 -0.691 . . . . 25.0 114.048 174.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 39.5 mt -124.95 153.73 42.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.48 0.64 . . . . 25.0 112.057 -173.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.0 m -139.23 161.66 28.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.021 -1.103 . . . . 25.0 108.021 177.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -93.21 132.75 37.09 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -111.24 101.91 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.249 0.547 . . . . 25.0 109.628 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.47 -19.09 64.44 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.704 1.001 . . . . 25.0 113.704 -175.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 p -71.65 -52.09 19.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.969 -0.457 . . . . 25.0 111.302 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.09 -1.99 32.65 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.034 0.753 . . . . 25.0 113.034 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.0 mptt 64.94 35.13 8.5 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.443 1.097 . . . . 25.0 108.457 177.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.6 m -105.58 157.21 17.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.233 -0.894 . . . . 25.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.1 t -103.26 121.64 43.13 Favored 'General case' 0 C--N 1.321 -0.652 1 N-CA-C 99.807 -4.146 . . . . 25.0 99.807 162.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -141.12 167.82 21.27 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -169.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -63.38 148.74 47.62 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.24 0.543 . . . . 25.0 111.916 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -68.06 1.32 2.83 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 115.601 1.704 . . . . 25.0 115.601 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.64 37.12 46.63 Favored Glycine 0 C--O 1.224 -0.521 0 C-N-CA 120.596 -0.811 . . . . 25.0 113.544 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.3 127.7 33.09 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 122.449 -0.442 . . . . 25.0 111.3 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 88.2 t -119.58 117.91 32.49 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 104.957 -2.238 . . . . 25.0 104.957 175.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.23 -25.4 7.16 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 117.134 -1.444 . . . . 25.0 115.612 -173.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 . . . . . 0 C--O 1.244 0.811 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 -177.43 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 CA-C-O 118.939 -0.923 . . . . 25.0 111.231 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.2 p -150.05 165.19 18.08 Favored Pre-proline 0 C--O 1.238 0.479 0 N-CA-C 106.798 -1.556 . . . . 25.0 106.798 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.41 155.47 46.72 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.225 -1.383 . . . . 25.0 111.063 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 61.72 -0.48 0.41 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.905 1.817 . . . . 25.0 115.905 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -60.33 -39.4 86.91 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.482 -0.761 . . . . 25.0 112.971 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.07 -0.57 15.61 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 112.515 0.561 . . . . 25.0 112.515 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.36 127.33 32.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 108.889 -0.782 . . . . 25.0 108.889 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.22 13.84 82.87 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 121.137 -0.554 . . . . 25.0 112.508 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -104.9 147.12 28.11 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.4 154.16 38.91 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 106.844 -1.539 . . . . 25.0 106.844 177.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -68.19 149.4 49.59 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.529 -0.915 . . . . 25.0 108.529 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.72 -175.1 20.46 Favored Glycine 0 C--O 1.234 0.105 0 N-CA-C 111.329 -0.708 . . . . 25.0 111.329 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.405 HD22 ' CD2' ' A' ' 23' ' ' PHE . 42.9 mt -97.93 147.49 24.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 25.0 112.286 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -128.49 147.64 64.83 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 107.729 -1.211 . . . . 25.0 107.729 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -73.57 150.77 46.21 Favored 'Trans proline' 0 C--N 1.346 0.421 0 N-CA-C 114.453 0.905 . . . . 25.0 114.453 -175.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -94.35 121.45 63.53 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.108 -1.071 . . . . 25.0 108.108 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.71 -18.82 21.89 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 116.262 -2.025 . . . . 25.0 113.718 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -88.66 -36.62 16.13 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 111.917 0.34 . . . . 25.0 111.917 -177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -116.09 149.45 38.94 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 114.328 1.233 . . . . 25.0 114.328 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -79.63 -58.07 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.88 -1.054 . . . . 25.0 112.037 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.8 m -98.0 21.56 10.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 116.124 1.898 . . . . 25.0 116.124 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 54.4 p -134.43 159.47 40.97 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.158 -0.682 . . . . 25.0 109.158 175.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.405 ' CD2' HD22 ' A' ' 13' ' ' LEU . 10.1 p90 -138.15 176.27 8.85 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.487 -0.778 . . . . 25.0 110.767 -172.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -107.85 144.93 34.37 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 104.116 -2.55 . . . . 25.0 104.116 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -130.13 140.2 50.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -120.69 133.05 55.38 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.507 -1.294 . . . . 25.0 107.507 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.5 109.48 4.47 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.3 36.39 26.96 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.645 0.736 . . . . 25.0 110.635 -177.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.29 -5.5 59.65 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 114.788 0.675 . . . . 25.0 114.788 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.0 mmt85 -84.15 148.93 26.51 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.251 -1.389 . . . . 25.0 107.251 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 131.46 52.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.963 -0.384 . . . . 25.0 109.963 -177.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -123.54 139.42 54.03 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 107.958 -1.126 . . . . 25.0 107.958 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -119.82 111.71 18.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.375 -1.713 . . . . 25.0 106.375 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -140.27 168.19 20.39 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.902 -0.407 . . . . 25.0 109.902 -173.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 62.1 p -112.2 159.5 18.52 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.088 0.774 . . . . 25.0 113.088 -176.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.86 90.12 50.2 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 105.434 -2.062 . . . . 25.0 105.434 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -79.79 -89.17 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 N-CA-C 117.053 1.905 . . . . 25.0 117.053 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 p -77.23 115.13 16.76 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.695 1.369 . . . . 25.0 114.695 -169.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.4 1.01 50.04 Favored Glycine 0 CA--C 1.519 0.304 0 N-CA-C 115.23 0.852 . . . . 25.0 115.23 174.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -103.71 134.31 47.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.795 0.331 . . . . 25.0 110.482 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.3 m -131.6 147.17 32.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.138 0.494 . . . . 25.0 110.12 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -80.61 135.83 36.13 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.629 -0.508 . . . . 25.0 109.629 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.6 t -109.45 101.54 10.49 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 107.866 -1.161 . . . . 25.0 107.866 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -60.37 -27.82 67.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.531 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.6 p -70.03 -41.26 74.48 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.224 0.453 . . . . 25.0 112.224 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.6 p -96.74 -10.47 26.75 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 -175.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mptt 66.4 31.11 8.45 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.183 0.993 . . . . 25.0 109.232 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.16 163.04 27.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.635 -0.711 . . . . 25.0 109.441 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.7 t -106.87 138.69 42.56 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 104.162 -2.533 . . . . 25.0 104.162 173.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -141.0 164.36 30.48 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.749 -0.463 . . . . 25.0 109.749 -174.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.2 t90 -71.54 147.45 47.67 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.667 -1.234 . . . . 25.0 107.667 175.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -61.95 122.75 16.25 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.249 -0.649 . . . . 25.0 109.249 178.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.89 -9.67 84.1 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 115.193 0.837 . . . . 25.0 115.193 -175.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.0 tp -83.8 107.25 16.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.956 0.878 . . . . 25.0 109.824 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.422 HG12 ' H ' ' A' ' 57' ' ' ARG . 45.5 t -112.22 125.41 30.18 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.287 -1.005 . . . . 25.0 108.287 -177.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.23 17.66 1.58 Allowed 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 121.471 1.447 . . . . 25.0 113.898 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' H ' HG12 ' A' ' 55' ' ' VAL . 82.6 mtp180 . . . . . 0 CA--C 1.505 -0.755 0 CA-C-O 118.368 -0.825 . . . . 25.0 109.512 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 118.832 -0.982 . . . . 25.0 111.379 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -146.8 151.85 43.16 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 105.158 -2.164 . . . . 25.0 105.158 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.13 111.19 2.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 116.015 -2.19 . . . . 25.0 112.069 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.8 p -60.32 -23.65 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.286 0.565 . . . . 25.0 112.219 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -59.4 -33.49 71.28 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.9 t -105.62 -11.38 16.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.287 0.565 . . . . 25.0 111.403 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -71.95 132.2 44.0 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.35 14.89 77.8 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.906 -0.664 . . . . 25.0 111.904 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -110.24 143.59 40.17 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.156 -0.683 . . . . 25.0 109.156 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.1 152.62 36.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 104.351 -2.463 . . . . 25.0 104.351 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -68.01 149.47 49.67 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.055 -0.72 . . . . 25.0 109.055 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.48 -176.11 21.61 Favored Glycine 0 N--CA 1.459 0.216 0 N-CA-C 110.88 -0.888 . . . . 25.0 110.88 -177.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.3 mt -94.71 145.51 24.8 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.88 0.84 . . . . 25.0 110.32 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -127.92 150.32 73.18 Favored Pre-proline 0 C--O 1.238 0.482 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.245 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.49 148.97 74.13 Favored 'Trans proline' 0 C--N 1.352 0.724 0 N-CA-C 114.127 0.78 . . . . 25.0 114.127 -178.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB3' ' HA ' ' A' ' 23' ' ' PHE . 12.6 p-10 -102.71 150.54 37.8 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 114.869 -1.06 . . . . 25.0 111.448 -173.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.01 -30.0 7.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 N-CA-C 116.578 1.722 . . . . 25.0 116.578 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 -78.34 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.931 0.787 . . . . 25.0 112.243 -176.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 34.43 -120.12 0.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.828 1.251 . . . . 25.0 113.262 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.6 tpt180 -155.82 -56.99 0.09 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.789 0.662 . . . . 25.0 112.789 177.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.1 m -153.68 39.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 p -137.93 157.27 46.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 -174.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.456 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 0.1 OUTLIER -149.42 175.9 11.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.398 -0.819 . . . . 25.0 108.88 -167.126 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -98.56 154.32 18.0 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.615 -0.883 . . . . 25.0 108.615 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -139.81 131.85 27.9 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -110.28 134.33 52.36 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 106.144 -1.798 . . . . 25.0 106.144 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.09 126.89 11.79 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.36 31.35 14.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.545 0.738 . . . . 25.0 111.895 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.16 69.75 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 115.434 0.934 . . . . 25.0 115.434 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -112.26 149.96 31.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 118.218 1.009 . . . . 25.0 108.483 177.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.95 133.65 33.92 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.226 0.824 . . . . 25.0 113.226 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.47 ' CE1' ' HD2' ' A' ' 30' ' ' ARG . 63.7 m-85 -117.33 146.64 43.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.463 -2.421 . . . . 25.0 104.463 165.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -117.23 131.58 56.82 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.562 -2.755 . . . . 25.0 103.562 169.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -136.88 169.41 17.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.6 0.593 . . . . 25.0 112.6 -168.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -136.31 157.79 45.96 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 101.082 -3.674 . . . . 25.0 101.082 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.8 m -106.45 108.3 61.57 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 103.9 -2.63 . . . . 25.0 103.9 177.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.35 -51.38 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.482 -1.878 . . . . 25.0 116.917 -164.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 p -105.75 114.47 28.65 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 115.663 1.727 . . . . 25.0 115.663 -172.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.69 4.04 37.55 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 117.66 1.824 . . . . 25.0 117.66 167.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -118.65 146.69 44.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.462 0.631 . . . . 25.0 111.117 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.07 151.04 33.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.069 -1.086 . . . . 25.0 108.069 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -80.32 118.89 22.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.343 0.592 . . . . 25.0 111.101 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.1 t -95.97 105.85 17.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.818 -1.179 . . . . 25.0 107.818 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -62.35 -28.88 70.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.528 0.566 . . . . 25.0 112.528 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -71.73 -33.48 68.75 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.936 -0.306 . . . . 25.0 111.148 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 51.9 t -84.6 -23.13 29.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 25.0 111.99 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 60.23 30.35 19.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 108.399 -0.963 . . . . 25.0 108.399 -170.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 10.4 p -143.3 165.04 28.58 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.241 -0.89 . . . . 25.0 108.851 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.45 136.47 33.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.706 -1.59 . . . . 25.0 106.706 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 34.0 p -121.16 158.9 26.96 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.201 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 -62.81 132.57 52.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.861 -1.163 . . . . 25.0 107.861 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -74.99 122.37 23.39 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.549 -0.46 . . . . 25.0 110.933 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.71 162.5 11.96 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 108.225 -1.95 . . . . 25.0 108.225 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.1 142.04 47.19 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 106.927 -1.508 . . . . 25.0 106.927 178.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.7 t -85.98 113.1 49.92 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 108.336 -0.987 . . . . 25.0 108.336 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -90.56 6.68 3.91 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 N-CA-C 116.34 1.631 . . . . 25.0 116.34 -172.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 117.996 -1.002 . . . . 25.0 109.511 -177.517 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 CA-C-O 118.346 -1.252 . . . . 25.0 111.477 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.32 153.26 81.6 Favored Pre-proline 0 N--CA 1.471 0.577 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -59.51 133.51 52.35 Favored 'Trans proline' 0 C--N 1.35 0.608 0 N-CA-C 115.065 1.141 . . . . 25.0 115.065 -174.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.41 -15.94 61.46 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 122.024 0.916 . . . . 25.0 111.704 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.41 -40.69 71.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.513 -1.221 . . . . 25.0 111.684 173.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.4 t -114.02 -3.82 13.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.521 0.563 . . . . 25.0 112.521 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -63.29 117.68 6.95 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 120.534 -1.354 . . . . 25.0 109.473 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.95 17.39 78.5 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 116.556 -0.293 . . . . 25.0 113.669 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -91.89 145.41 24.57 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.37 148.51 51.53 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 106.862 -1.533 . . . . 25.0 106.862 179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -68.24 144.25 54.97 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.63 -177.1 21.48 Favored Glycine 0 C--O 1.242 0.633 0 N-CA-C 109.765 -1.334 . . . . 25.0 109.765 -176.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 23' ' ' PHE . 27.9 mt -96.66 151.8 19.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.264 1.03 . . . . 25.0 112.092 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -132.01 153.45 81.37 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 114.869 -1.059 . . . . 25.0 110.21 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.6 143.44 38.07 Favored 'Trans proline' 0 C--N 1.354 0.851 0 N-CA-C 116.11 1.542 . . . . 25.0 116.11 -174.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -88.73 158.61 47.69 Favored Pre-proline 0 CA--C 1.555 1.167 0 CA-C-N 114.877 -1.056 . . . . 25.0 111.539 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.62 -18.71 3.02 Favored 'Trans proline' 0 C--N 1.353 0.813 0 N-CA-C 118.927 2.626 . . . . 25.0 118.927 -176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -133.95 -59.77 0.83 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 117.124 2.268 . . . . 25.0 117.124 -172.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -70.38 161.46 30.43 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 114.463 1.283 . . . . 25.0 114.463 -167.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -64.81 -41.97 95.38 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 115.654 1.724 . . . . 25.0 115.654 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.9 m -129.34 3.35 5.14 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.118 1.895 . . . . 25.0 116.118 -173.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.4 p -77.71 165.29 24.41 Favored 'General case' 0 C--O 1.212 -0.874 0 O-C-N 121.208 -0.933 . . . . 25.0 110.122 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.461 ' CD2' HD22 ' A' ' 13' ' ' LEU . 16.5 p90 -148.89 168.69 22.34 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.214 1.007 . . . . 25.0 111.107 177.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -100.98 153.92 19.12 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.882 -2.636 . . . . 25.0 103.882 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.9 t -140.63 149.07 41.83 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 106.785 -1.561 . . . . 25.0 106.785 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m -123.79 129.38 50.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 105.612 -1.995 . . . . 25.0 105.612 176.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.2 119.54 14.74 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.283 -1.006 . . . . 25.0 108.283 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.39 35.38 17.22 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 123.45 0.7 . . . . 25.0 111.965 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.88 14.38 78.47 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.578 0.591 . . . . 25.0 114.578 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -109.48 143.96 38.39 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.57 137.7 37.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.765 0.793 . . . . 25.0 112.684 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -128.95 136.16 49.99 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 106.355 -1.72 . . . . 25.0 106.355 166.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -125.09 113.0 17.16 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 103.891 -2.633 . . . . 25.0 103.891 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -137.14 162.58 33.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.082 0.467 . . . . 25.0 111.418 -170.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -108.36 149.85 28.13 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.162 -0.681 . . . . 25.0 109.162 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.04 120.98 47.17 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 103.322 -2.844 . . . . 25.0 103.322 175.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.45 -84.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 N-CA-C 118.19 2.342 . . . . 25.0 118.19 -165.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.3 m -97.53 114.96 26.95 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.896 1.813 . . . . 25.0 115.896 -169.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.74 26.37 69.6 Favored Glycine 0 C--O 1.221 -0.673 0 N-CA-C 116.436 1.335 . . . . 25.0 116.436 170.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -115.64 161.97 17.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.083 0.942 . . . . 25.0 111.311 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -138.83 171.35 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 106.583 -1.636 . . . . 25.0 106.583 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -101.69 137.5 39.92 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.921 0.782 . . . . 25.0 110.007 177.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 45.9 t -116.82 108.17 15.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 122.129 0.966 . . . . 25.0 111.076 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -65.41 -24.28 67.16 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 113.112 0.782 . . . . 25.0 113.112 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.9 p -66.61 -40.32 88.76 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.137 -0.352 . . . . 25.0 111.07 -176.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 p -103.89 -7.83 20.16 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.595 -0.442 . . . . 25.0 111.8 -177.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm 62.56 35.45 14.45 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.659 0.783 . . . . 25.0 110.266 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.54 160.75 28.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.49 0.662 . . . . 25.0 110.635 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 43.8 t -86.27 128.2 34.88 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.122 -3.288 . . . . 25.0 102.122 168.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.7 p -126.92 163.97 22.48 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 122.581 0.352 . . . . 25.0 111.363 -172.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -65.44 146.84 54.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.895 0.379 . . . . 25.0 111.636 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -64.17 -28.99 70.13 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 112.863 0.69 . . . . 25.0 112.863 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 91.36 -3.21 79.23 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 115.206 0.842 . . . . 25.0 115.206 175.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.49 121.16 14.26 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.735 0.768 . . . . 25.0 111.938 178.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.16 125.18 28.42 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 106.316 -1.735 . . . . 25.0 106.316 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -85.4 -7.65 8.8 Favored 'Trans proline' 0 C--N 1.347 0.453 0 N-CA-C 116.284 1.609 . . . . 25.0 116.284 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 . . . . . 0 C--O 1.247 0.938 0 N-CA-C 109.579 -0.526 . . . . 25.0 109.579 -178.597 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.012 0 CA-C-O 119.206 -0.775 . . . . 25.0 111.62 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.2 t -152.05 156.26 33.91 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 104.384 -2.45 . . . . 25.0 104.384 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -60.95 143.67 99.4 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 116.569 -1.821 . . . . 25.0 113.377 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -67.29 -20.14 65.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.797 0.808 . . . . 25.0 109.806 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.71 -36.71 70.0 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.083 -0.962 . . . . 25.0 111.912 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.72 -0.99 21.42 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.853 0.686 . . . . 25.0 112.853 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -74.53 128.64 36.06 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 121.612 -0.68 . . . . 25.0 109.302 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 76.59 22.18 73.17 Favored Glycine 0 C--O 1.227 -0.288 0 C-N-CA 120.964 -0.636 . . . . 25.0 112.881 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -113.44 148.15 36.46 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.892 -0.781 . . . . 25.0 108.892 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.72 31.02 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.39 142.83 56.6 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.877 -0.786 . . . . 25.0 108.877 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.75 -174.22 22.76 Favored Glycine 0 C--O 1.229 -0.156 0 C-N-CA 121.21 -0.519 . . . . 25.0 113.122 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.5 mt -96.67 148.83 22.47 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.593 0.357 . . . . 25.0 110.332 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -131.08 148.19 69.28 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-N 116.028 -0.533 . . . . 25.0 111.381 -176.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.12 147.45 60.6 Favored 'Trans proline' 0 C--N 1.351 0.708 0 N-CA-C 113.656 0.599 . . . . 25.0 113.656 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -121.89 150.81 56.77 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 114.965 -1.016 . . . . 25.0 111.259 -172.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -86.12 -18.85 3.34 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 N-CA-C 117.712 2.158 . . . . 25.0 117.712 -174.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -117.16 -58.62 2.04 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 116.453 2.02 . . . . 25.0 116.453 -168.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.4 mp0 -68.3 150.17 48.55 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.202 0.525 . . . . 25.0 111.865 -173.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.16 -65.39 1.02 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-O 121.505 0.669 . . . . 25.0 111.555 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -95.32 24.56 4.96 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.565 0.95 . . . . 25.0 113.565 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.06 162.04 37.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.525 -1.287 . . . . 25.0 107.525 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.6 -177.85 6.63 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.298 -1.001 . . . . 25.0 108.298 -163.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -101.82 156.84 17.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.59 -1.633 . . . . 25.0 106.59 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.0 t -143.75 145.6 32.51 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 107.826 -1.176 . . . . 25.0 107.826 -178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 t -131.73 130.88 42.51 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.25 -1.019 . . . . 25.0 108.25 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.13 123.22 12.11 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.178 -1.045 . . . . 25.0 108.178 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 53.48 34.39 18.21 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.61 0.764 . . . . 25.0 112.444 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.59 13.35 82.03 Favored Glycine 0 C--O 1.237 0.342 0 C-N-CA 121.217 -0.516 . . . . 25.0 113.862 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -108.26 140.12 41.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.767 -1.198 . . . . 25.0 107.767 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 41.5 tp -87.77 128.65 35.32 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.315 0.384 . . . . 25.0 110.262 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -122.02 140.78 52.08 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 104.421 -2.437 . . . . 25.0 104.421 169.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -114.0 122.15 46.04 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 102.989 -2.967 . . . . 25.0 102.989 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -136.42 164.56 27.87 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 113.739 1.014 . . . . 25.0 113.739 -166.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.3 p -123.37 160.83 25.94 Favored 'General case' 0 C--N 1.32 -0.7 1 N-CA-C 100.191 -4.003 . . . . 25.0 100.191 164.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -101.55 123.5 44.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 106.021 -1.844 . . . . 25.0 106.021 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.43 -55.43 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 115.435 -2.576 . . . . 25.0 116.492 -170.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.58 85.0 6.6 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 115.389 1.625 . . . . 25.0 115.389 -174.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.53 -9.51 0.85 Allowed Glycine 0 CA--C 1.528 0.889 0 N-CA-C 118.284 2.073 . . . . 25.0 118.284 168.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 31.6 mt -81.07 155.92 26.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 118.163 0.981 . . . . 25.0 113.11 -166.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.4 m -124.14 151.82 29.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 107.449 -1.315 . . . . 25.0 107.449 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -75.25 126.64 31.44 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.404 -0.81 . . . . 25.0 109.334 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.4 t -109.94 109.49 20.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.403 -0.962 . . . . 25.0 108.403 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.83 -14.01 60.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.723 1.008 . . . . 25.0 113.723 -176.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.5 p -71.48 -47.86 52.89 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.299 -0.876 . . . . 25.0 110.249 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.2 p -92.78 -6.66 48.48 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.772 1.027 . . . . 25.0 113.772 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 59.94 35.16 21.65 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.108 -1.441 . . . . 25.0 107.108 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.0 p -142.91 168.03 20.67 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.584 -0.734 . . . . 25.0 110.389 -172.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.73 131.27 43.6 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.101 -1.074 . . . . 25.0 108.101 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.0 p -124.86 152.96 43.32 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.699 0.285 . . . . 25.0 110.369 -176.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.0 t90 -72.48 146.38 46.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 107.35 -1.352 . . . . 25.0 107.35 174.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -79.82 84.12 5.66 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.024 0.44 . . . . 25.0 111.392 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -91.65 32.91 5.05 Favored Glycine 0 C--O 1.227 -0.284 0 CA-C-N 116.084 -0.507 . . . . 25.0 113.335 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 8.4 tp -74.45 106.74 6.2 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.081 0.467 . . . . 25.0 110.19 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.456 HG12 ' H ' ' A' ' 57' ' ' ARG . 58.7 t -79.24 121.91 83.58 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 107.319 -1.363 . . . . 25.0 107.319 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -84.97 7.9 4.93 Favored 'Trans proline' 0 C--N 1.349 0.58 0 N-CA-C 114.38 0.877 . . . . 25.0 114.38 -177.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.456 ' H ' HG12 ' A' ' 55' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.245 0.852 0 CA-C-O 117.298 -1.334 . . . . 25.0 110.889 -176.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.975 0 CA-C-O 119.733 -0.481 . . . . 25.0 112.249 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.8 t -65.67 139.11 96.92 Favored Pre-proline 0 N--CA 1.478 0.959 0 CA-C-N 117.273 0.537 . . . . 25.0 110.34 177.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.49 119.73 6.84 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 116.466 -1.889 . . . . 25.0 115.073 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 24.4 p -76.63 -1.98 30.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.881 0.848 . . . . 25.0 109.985 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -56.27 -31.34 63.51 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.302 -0.863 . . . . 25.0 111.384 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.6 t -110.98 -16.28 13.56 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.475 0.917 . . . . 25.0 113.475 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.81 126.14 28.09 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 119.297 -0.961 . . . . 25.0 108.498 177.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 10.88 72.34 Favored Glycine 0 CA--C 1.521 0.454 0 CA-C-N 115.544 -0.753 . . . . 25.0 113.544 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -106.91 149.39 27.51 Favored 'General case' 0 CA--C 1.504 -0.813 0 O-C-N 121.448 -1.03 . . . . 25.0 108.392 178.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.48 151.43 41.05 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 105.83 -1.915 . . . . 25.0 105.83 176.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.78 150.36 49.23 Favored 'General case' 0 C--O 1.246 0.904 0 N-CA-C 107.578 -1.268 . . . . 25.0 107.578 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.0 179.59 19.13 Favored Glycine 0 C--O 1.242 0.612 0 N-CA-C 110.097 -1.201 . . . . 25.0 110.097 -175.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.2 mt -101.33 149.44 24.03 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 112.865 0.691 . . . . 25.0 112.865 -177.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -132.79 144.12 51.57 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 107.622 -1.251 . . . . 25.0 107.622 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -73.16 149.19 45.59 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 117.32 -1.32 . . . . 25.0 114.249 -174.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -96.3 118.27 65.58 Favored Pre-proline 0 C--O 1.216 -0.702 0 N-CA-C 108.586 -0.894 . . . . 25.0 108.586 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -79.92 -13.18 13.04 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 115.415 1.275 . . . . 25.0 115.415 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -87.41 -42.73 12.62 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.151 0.501 . . . . 25.0 111.167 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -97.94 155.32 17.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.16 -0.927 . . . . 25.0 112.689 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -69.2 -46.85 66.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.521 1.674 . . . . 25.0 115.521 -177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -130.44 20.75 5.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.742 1.756 . . . . 25.0 115.742 -167.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 63.1 p -111.01 164.15 13.11 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.122 -1.066 . . . . 25.0 108.122 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -135.13 166.58 22.75 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 122.128 0.966 . . . . 25.0 108.591 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -97.6 145.78 25.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 101.209 -3.626 . . . . 25.0 101.209 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -135.76 138.44 42.66 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.4 m -114.13 123.95 50.88 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.825 -0.805 . . . . 25.0 108.825 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.98 113.62 13.62 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 52.81 38.54 26.88 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.913 0.758 . . . . 25.0 109.383 -177.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.36 15.2 74.85 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 115.565 0.986 . . . . 25.0 115.565 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -113.57 149.18 34.85 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 173.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -93.3 130.44 39.03 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 113.674 0.99 . . . . 25.0 113.674 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.97 137.83 53.23 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 106.916 -1.513 . . . . 25.0 106.916 169.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -117.65 108.98 16.09 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 105.332 -2.099 . . . . 25.0 105.332 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.73 165.4 27.39 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.188 -0.32 . . . . 25.0 110.786 -168.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 46.2 p -102.82 164.11 11.82 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.849 0.833 . . . . 25.0 111.623 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.18 95.8 38.2 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 104.5 -2.407 . . . . 25.0 104.5 167.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -91.83 -119.13 0.01 OUTLIER 'Trans proline' 0 C--O 1.25 1.12 0 C-N-CA 120.435 0.757 . . . . 25.0 113.211 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.49 142.61 58.36 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 121.115 -0.99 . . . . 25.0 112.185 -178.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 79.27 -7.6 51.67 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 116.947 1.539 . . . . 25.0 116.947 173.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.6 mt -131.83 142.69 49.79 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.146 0.973 . . . . 25.0 111.773 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.8 149.71 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -90.1 132.39 35.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.657 0.742 . . . . 25.0 112.631 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.8 t -113.32 102.64 10.54 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 121.726 0.774 . . . . 25.0 109.737 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -63.74 -27.75 69.41 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 114.385 1.254 . . . . 25.0 114.385 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 p -67.7 -35.67 79.23 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.053 0.39 . . . . 25.0 112.053 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.3 p -104.83 -7.82 19.16 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.079 0.4 . . . . 25.0 112.079 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm 59.43 44.76 14.57 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.087 1.355 . . . . 25.0 113.069 -174.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.02 168.08 16.56 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.02 -0.991 . . . . 25.0 110.998 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.23 132.3 53.22 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 103.119 -2.919 . . . . 25.0 103.119 168.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 77.1 p -118.69 158.5 25.39 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.76 0.791 . . . . 25.0 111.314 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -70.02 137.42 51.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.098 -0.955 . . . . 25.0 109.354 178.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -99.5 105.23 17.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.066 0.46 . . . . 25.0 111.836 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -172.1 -35.34 0.03 OUTLIER Glycine 0 C--O 1.209 -1.46 0 C-N-CA 120.912 -0.661 . . . . 25.0 114.117 -179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 126.14 30.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 118.0 0.9 . . . . 25.0 110.862 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.2 t -130.62 117.88 17.7 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 109.901 -0.407 . . . . 25.0 109.901 176.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -85.43 -3.45 9.33 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 121.58 1.52 . . . . 25.0 114.365 -176.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? . . . . . 0 CA--C 1.511 -0.541 0 N-CA-C 106.679 -1.6 . . . . 25.0 106.679 -178.8 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.036 0 CA-C-O 118.788 -1.007 . . . . 25.0 111.389 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.3 t -138.31 143.44 38.89 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 106.184 -1.784 . . . . 25.0 106.184 178.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.07 -14.26 18.95 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 117.521 -1.186 . . . . 25.0 114.043 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.6 p 48.03 26.23 0.95 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.136 1.161 . . . . 25.0 114.136 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -64.53 -45.42 87.23 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 113.959 1.096 . . . . 25.0 113.959 -173.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.34 -7.31 13.98 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.563 0.697 . . . . 25.0 111.979 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -70.85 122.51 20.05 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 116.154 -0.476 . . . . 25.0 109.83 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.32 19.95 68.01 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 121.173 -0.537 . . . . 25.0 113.041 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -119.48 149.86 41.19 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 117.171 0.486 . . . . 25.0 111.097 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 153.27 42.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.245 -178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 26' ' ' CYS . 72.6 m-20 -70.45 148.41 48.35 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.652 -0.704 . . . . 25.0 110.353 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.23 -179.41 23.26 Favored Glycine 0 CA--C 1.517 0.169 0 N-CA-C 109.942 -1.263 . . . . 25.0 109.942 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -98.75 143.93 28.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.286 1.043 . . . . 25.0 111.108 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -125.98 148.2 61.95 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.665 -0.495 . . . . 25.0 109.665 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.35 148.86 55.84 Favored 'Trans proline' 0 C--N 1.35 0.614 0 N-CA-C 115.249 1.211 . . . . 25.0 115.249 -175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -84.07 154.77 64.05 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-N 114.408 -1.269 . . . . 25.0 110.38 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -81.48 -21.15 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 N-CA-C 115.981 1.493 . . . . 25.0 115.981 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 -29.67 0.49 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.3 1.593 . . . . 25.0 115.3 -169.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -74.47 -178.51 3.56 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 124.482 1.113 . . . . 25.0 112.349 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -134.96 -56.05 0.82 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.498 -0.751 . . . . 25.0 111.549 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -79.87 -2.84 45.36 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.268 0.84 . . . . 25.0 113.268 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.5 p -130.36 154.58 47.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.437 . . . . 25.0 110.529 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -177.93 6.07 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.279 -1.008 . . . . 25.0 108.279 -170.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -106.04 158.87 16.49 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.973 -1.491 . . . . 25.0 106.973 176.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.1 t -142.73 153.41 43.3 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.091 -1.448 . . . . 25.0 107.091 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.514 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -126.46 128.29 46.73 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 104.46 -2.422 . . . . 25.0 104.46 175.184 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.85 118.76 11.81 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.97 -1.493 . . . . 25.0 106.97 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 55.71 33.72 21.91 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.801 0.84 . . . . 25.0 110.352 -173.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.15 7.94 68.46 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 114.619 0.608 . . . . 25.0 114.619 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -101.46 153.26 19.86 Favored 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 121.863 -0.786 . . . . 25.0 108.98 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.98 128.8 33.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.144 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.33 149.52 52.34 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.264 -2.495 . . . . 25.0 104.264 169.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -113.97 146.18 40.49 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 103.125 -2.917 . . . . 25.0 103.125 171.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -129.16 164.7 22.81 Favored 'General case' 0 CA--C 1.499 -0.998 0 N-CA-C 109.144 -0.687 . . . . 25.0 109.144 -171.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.0 p -146.58 155.03 42.18 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 102.022 -3.325 . . . . 25.0 102.022 171.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -116.76 117.55 37.52 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 103.086 -2.931 . . . . 25.0 103.086 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.86 -87.6 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 117.528 -1.181 . . . . 25.0 114.676 -171.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.4 t -104.07 153.11 21.27 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.565 -0.709 . . . . 25.0 110.874 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -10.48 4.71 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 118.968 2.347 . . . . 25.0 118.968 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 51' ' ' TRP . 73.5 mt -129.31 144.77 51.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 118.09 0.945 . . . . 25.0 109.439 -176.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 23.9 m -135.47 147.19 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 109.508 -0.553 . . . . 25.0 109.508 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -77.55 130.34 36.81 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.392 -0.818 . . . . 25.0 109.662 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -126.49 122.73 36.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.49 0.662 . . . . 25.0 109.638 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -64.31 -21.72 66.7 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 70.4 p -67.67 -32.25 72.78 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.784 0.265 . . . . 25.0 111.467 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.9 t -94.11 -21.75 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.438 -0.578 . . . . 25.0 109.438 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.3 tptt 60.32 26.85 16.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.982 -1.008 . . . . 25.0 108.46 -171.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -143.26 171.69 13.76 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.286 -1.324 . . . . 25.0 107.663 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.3 t -88.25 127.06 35.45 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.433 -1.691 . . . . 25.0 106.433 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 41.8 p -112.67 161.52 16.76 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.409 -0.589 . . . . 25.0 109.409 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.406 ' HA ' HD23 ' A' ' 40' ' ' LEU . 21.6 t90 -67.38 146.71 53.77 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.34 -0.615 . . . . 25.0 109.34 177.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -78.37 70.31 4.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.3 0.572 . . . . 25.0 111.477 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.38 51.8 4.61 Favored Glycine 0 C--O 1.227 -0.343 0 CA-C-N 115.902 -0.59 . . . . 25.0 112.956 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tt -66.82 130.78 44.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.914 -0.402 . . . . 25.0 109.914 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.431 HG12 ' H ' ' A' ' 57' ' ' ARG . 60.3 t -116.69 131.8 23.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 105.901 -1.888 . . . . 25.0 105.901 178.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -85.94 14.61 2.41 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 121.143 1.229 . . . . 25.0 113.647 -177.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.431 ' H ' HG12 ' A' ' 55' ' ' VAL . 76.2 mtp85 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.214 -0.898 . . . . 25.0 109.468 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.995 0 CA-C-O 118.879 -0.956 . . . . 25.0 111.392 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.6 t -65.96 144.54 98.85 Favored Pre-proline 0 N--CA 1.469 0.507 0 CA-C-N 118.34 1.07 . . . . 25.0 108.943 177.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.06 -25.26 27.4 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 116.378 -1.948 . . . . 25.0 114.012 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.9 p -85.49 -2.93 58.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.263 0.554 . . . . 25.0 111.447 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -58.35 -39.48 79.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.092 0.775 . . . . 25.0 113.092 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.06 2.34 16.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.916 0.71 . . . . 25.0 112.916 -177.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -69.66 123.9 22.58 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 109.452 -0.573 . . . . 25.0 109.452 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 72.65 17.93 78.35 Favored Glycine 0 C--O 1.226 -0.37 0 C-N-CA 121.216 -0.516 . . . . 25.0 113.706 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 mptm? -102.23 145.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-N 117.66 0.73 . . . . 25.0 109.995 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 152.35 44.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.857 -1.065 . . . . 25.0 108.868 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.66 160.39 22.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.667 -0.697 . . . . 25.0 111.899 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.11 -176.55 16.21 Favored Glycine 0 N--CA 1.458 0.143 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.966 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -96.33 151.88 19.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.48 0.657 . . . . 25.0 111.539 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -132.64 147.31 65.04 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 106.094 -1.817 . . . . 25.0 106.094 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.61 146.38 49.09 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 117.368 -1.288 . . . . 25.0 113.528 -175.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -107.59 124.19 35.75 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-N 116.43 -0.35 . . . . 25.0 110.147 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.71 -15.96 8.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 116.234 1.59 . . . . 25.0 116.234 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -123.24 -47.03 2.03 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 119.554 3.168 . . . . 25.0 119.554 -170.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.36 -65.76 0.51 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 116.273 1.953 . . . . 25.0 116.273 -164.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -172.47 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.985 -0.746 . . . . 25.0 108.985 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.3 p -118.36 14.98 13.88 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 106.286 -1.746 . . . . 25.0 106.286 175.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.86 175.25 9.75 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 114.251 -1.34 . . . . 25.0 110.374 -178.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -133.32 -179.46 5.52 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.978 -1.119 . . . . 25.0 107.978 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -107.86 145.17 34.05 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.621 -3.103 . . . . 25.0 102.621 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -134.33 143.14 47.51 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 106.609 -1.626 . . . . 25.0 106.609 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.91 127.7 52.1 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 177.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.17 120.59 14.98 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 54.72 32.25 17.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.645 0.778 . . . . 25.0 111.855 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.2 79.77 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 121.119 -0.562 . . . . 25.0 113.669 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -118.62 148.36 42.79 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.678 -1.23 . . . . 25.0 107.678 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 51.4 tp -91.41 129.17 37.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.53 0.566 . . . . 25.0 112.53 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -120.72 132.56 55.14 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.429 -1.693 . . . . 25.0 106.429 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -113.98 107.34 15.54 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 104.309 -2.478 . . . . 25.0 104.309 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -143.51 169.62 17.36 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.788 -0.449 . . . . 25.0 109.788 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.6 p -117.42 160.07 21.77 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.274 -0.639 . . . . 25.0 109.274 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.53 127.68 55.7 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 107.371 -1.344 . . . . 25.0 107.371 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.83 -55.68 0.25 Allowed 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 116.091 -2.139 . . . . 25.0 117.028 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -106.31 143.75 33.99 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.709 -0.619 . . . . 25.0 112.275 -179.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.08 14.39 70.93 Favored Glycine 0 C--O 1.222 -0.597 0 N-CA-C 115.909 1.124 . . . . 25.0 115.909 169.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.3 111.6 0.6 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 118.945 2.943 . . . . 25.0 118.945 -160.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.3 m -145.62 161.49 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 N-CA-C 104.569 -2.382 . . . . 25.0 104.569 165.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -116.05 130.03 56.63 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.678 -0.49 . . . . 25.0 109.678 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.2 t -110.17 114.22 27.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.843 0.83 . . . . 25.0 109.812 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -63.01 -31.35 72.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.386 -0.824 . . . . 25.0 113.118 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 44.4 p -65.57 -32.07 73.46 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 28.3 p -104.51 -5.38 21.62 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.39 -0.226 . . . . 25.0 110.39 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? 52.3 41.25 30.37 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.468 -0.938 . . . . 25.0 108.468 -173.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.4 p -143.15 168.37 19.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.613 -0.722 . . . . 25.0 111.417 -172.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.3 t -86.21 139.93 30.61 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.061 -1.459 . . . . 25.0 107.061 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 38.9 p -128.02 167.84 16.14 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 105.497 -2.038 . . . . 25.0 105.497 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.7 148.66 31.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.243 -1.762 . . . . 25.0 106.243 174.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -63.23 140.53 58.88 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.174 -0.676 . . . . 25.0 109.174 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.02 -6.16 68.16 Favored Glycine 0 CA--C 1.52 0.36 0 N-CA-C 115.363 0.905 . . . . 25.0 115.363 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.64 159.0 15.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 118.049 0.924 . . . . 25.0 112.885 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 57' ' ' ARG . 40.8 t -85.92 136.58 36.27 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 106.356 -1.72 . . . . 25.0 106.356 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -79.26 4.14 6.84 Favored 'Trans proline' 0 C--N 1.351 0.677 0 N-CA-C 114.62 0.969 . . . . 25.0 114.62 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.435 ' H ' HG12 ' A' ' 55' ' ' VAL . 27.5 mtp180 . . . . . 0 C--O 1.241 0.616 0 C-N-CA 123.573 0.749 . . . . 25.0 108.981 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 CA-C-O 119.102 -0.832 . . . . 25.0 111.469 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.0 t -64.26 131.27 94.98 Favored Pre-proline 0 N--CA 1.467 0.378 0 CA-C-N 118.183 0.991 . . . . 25.0 111.155 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -74.76 -28.2 9.83 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 116.39 -1.94 . . . . 25.0 113.637 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.4 p -75.83 -21.01 57.72 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 121.228 0.537 . . . . 25.0 112.055 -175.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.558 ' CD1' HD13 ' A' ' 31' ' ' LEU . 77.1 t80 -64.91 -28.85 69.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.353 -0.385 . . . . 25.0 111.913 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -111.31 10.11 21.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.625 -0.262 . . . . 25.0 111.529 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -73.69 138.8 44.93 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 71.65 17.58 76.65 Favored Glycine 0 C--O 1.227 -0.31 0 C-N-CA 121.027 -0.606 . . . . 25.0 112.733 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -126.33 147.72 49.68 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.125 -0.695 . . . . 25.0 109.125 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.17 156.56 35.76 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -69.94 148.07 49.41 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.744 -1.206 . . . . 25.0 107.744 175.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.04 -174.39 24.41 Favored Glycine 0 N--CA 1.454 -0.124 0 N-CA-C 110.243 -1.143 . . . . 25.0 110.243 -175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.2 mt -97.64 148.85 22.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.427 0.614 . . . . 25.0 111.347 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -132.13 154.51 81.69 Favored Pre-proline 0 C--O 1.24 0.568 0 N-CA-C 112.111 0.412 . . . . 25.0 112.111 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.413 ' HB3' HD21 ' A' ' 44' ' ' ASN . 59.4 Cg_endo -65.07 131.1 27.55 Favored 'Trans proline' 0 C--N 1.357 0.984 0 N-CA-C 114.346 0.864 . . . . 25.0 114.346 -177.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -118.8 150.69 48.92 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.562 -172.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.65 -19.44 4.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 N-CA-C 117.3 2.0 . . . . 25.0 117.3 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -79.49 -59.85 2.59 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 116.235 1.939 . . . . 25.0 116.235 -166.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.91 151.24 40.8 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.252 0.464 . . . . 25.0 112.252 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -60.45 -33.2 72.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.766 0.826 . . . . 25.0 111.142 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 p -85.69 -0.34 54.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.769 -1.105 . . . . 25.0 113.684 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 91.2 p -122.46 167.54 13.21 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 -178.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -154.83 173.89 15.84 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.409 0.623 . . . . 25.0 111.764 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -102.83 145.29 29.99 Favored 'General case' 0 CA--C 1.503 -0.846 0 N-CA-C 102.343 -3.206 . . . . 25.0 102.343 169.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.2 t -135.72 141.62 44.92 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.2 m -117.11 127.54 54.24 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 105.732 -1.951 . . . . 25.0 105.732 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.68 128.52 23.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.835 -1.913 . . . . 25.0 105.835 177.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 56.29 28.54 13.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.986 0.914 . . . . 25.0 110.578 -173.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 69.17 23.37 76.23 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 121.202 -0.523 . . . . 25.0 113.799 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 82.1 mmt-85 -123.82 149.37 45.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 117.855 0.827 . . . . 25.0 109.013 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.558 HD13 ' CD1' ' A' ' 5' ' ' PHE . 51.2 tp -79.42 127.9 32.68 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 114.046 1.128 . . . . 25.0 114.046 -177.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -123.86 131.96 53.67 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 167.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -113.98 124.31 51.85 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.202 -1.777 . . . . 25.0 106.202 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -143.49 170.94 14.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.024 -0.361 . . . . 25.0 110.024 -172.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 69.8 p -121.31 162.79 19.69 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 176.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 4.5 t -123.14 71.53 44.4 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 106.474 -1.676 . . . . 25.0 106.474 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.27 -27.71 9.36 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 116.201 -2.066 . . . . 25.0 117.277 -164.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.07 86.41 5.53 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.505 1.298 . . . . 25.0 114.505 -175.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.98 2.14 29.31 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.312 2.085 . . . . 25.0 118.312 168.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.0 mt -122.69 162.87 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.215 1.007 . . . . 25.0 111.158 -173.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.31 159.82 40.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.457 -0.338 . . . . 25.0 110.66 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.78 125.89 29.15 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.258 -0.577 . . . . 25.0 110.351 176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -107.2 109.72 21.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.862 0.839 . . . . 25.0 109.226 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.413 HD21 ' HB3' ' A' ' 15' ' ' PRO . 0.7 OUTLIER -66.29 -20.55 66.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.11 1.152 . . . . 25.0 114.11 -176.101 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.6 p -70.75 -43.65 68.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.545 0.572 . . . . 25.0 112.545 -177.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 13.9 p -104.5 -6.96 20.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.93 0.344 . . . . 25.0 111.93 -177.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 61.66 39.32 14.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.857 0.863 . . . . 25.0 110.928 -176.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -125.96 169.14 13.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.577 -0.738 . . . . 25.0 109.505 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.5 t -99.16 122.89 42.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 169.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.3 t -146.24 173.67 12.02 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.062 0.145 . . . . 25.0 110.676 -173.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -57.17 148.71 21.42 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.94 0.4 . . . . 25.0 111.569 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.61 61.92 3.74 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.628 0.973 . . . . 25.0 113.628 -177.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.2 43.49 79.97 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 115.752 1.061 . . . . 25.0 115.752 173.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 7.4 tt -66.55 128.55 36.66 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.144 -0.687 . . . . 25.0 109.144 177.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.463 HG12 ' H ' ' A' ' 57' ' ' ARG . 55.5 t -119.54 131.85 24.23 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 106.436 -1.69 . . . . 25.0 106.436 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -83.03 5.74 6.24 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 N-CA-C 114.784 1.032 . . . . 25.0 114.784 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.463 ' H ' HG12 ' A' ' 55' ' ' VAL . 4.2 mmp_? . . . . . 0 C--O 1.242 0.669 0 N-CA-C 106.636 -1.616 . . . . 25.0 106.636 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.963 0 CA-C-O 118.717 -1.046 . . . . 25.0 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.1 t 66.26 151.69 0.12 Allowed Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 113.368 0.877 . . . . 25.0 113.368 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -60.69 -25.05 80.19 Favored 'Trans proline' 0 C--O 1.204 -1.186 0 C-N-CA 116.192 -2.072 . . . . 25.0 116.794 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 62.03 -2.32 0.31 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 114.234 1.198 . . . . 25.0 114.234 -174.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.27 -37.32 86.82 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 125.02 1.328 . . . . 25.0 114.008 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -104.34 -1.98 26.16 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 118.437 0.562 . . . . 25.0 111.429 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -74.73 127.17 32.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 122.645 1.212 . . . . 25.0 108.661 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.9 -8.35 70.26 Favored Glycine 0 CA--C 1.546 2.006 0 CA-C-N 113.959 -1.473 . . . . 25.0 113.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -88.44 146.51 25.18 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 122.107 -0.643 . . . . 25.0 110.842 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.97 154.73 35.63 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.074 -1.084 . . . . 25.0 108.074 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -63.5 148.11 49.56 Favored 'General case' 0 CA--C 1.556 1.207 0 N-CA-C 109.906 -0.405 . . . . 25.0 109.906 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.36 -169.64 25.37 Favored Glycine 0 C--O 1.211 -1.3 0 N-CA-C 110.485 -1.046 . . . . 25.0 110.485 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.5 mt -115.37 138.19 51.25 Favored 'General case' 0 CA--C 1.488 -1.44 0 O-C-N 120.502 -1.587 . . . . 25.0 110.835 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -124.99 146.45 53.55 Favored Pre-proline 0 C--O 1.218 -0.567 0 C-N-CA 125.198 1.399 . . . . 25.0 108.317 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 151.21 40.96 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 115.998 -2.201 . . . . 25.0 113.901 -171.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -87.37 138.07 32.28 Favored Pre-proline 0 CA--C 1.556 1.21 0 N-CA-C 109.1 -0.704 . . . . 25.0 109.1 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -79.41 -19.79 10.04 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 N-CA-C 116.107 1.541 . . . . 25.0 116.107 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -102.14 -42.38 6.08 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.941 -0.474 . . . . 25.0 111.816 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -106.44 162.16 13.95 Favored 'General case' 0 C--O 1.206 -1.185 0 N-CA-C 108.9 -0.778 . . . . 25.0 108.9 173.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.52 -8.05 10.53 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 116.484 2.031 . . . . 25.0 116.484 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.23 10.36 31.83 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 107.849 -1.167 . . . . 25.0 107.849 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 35' ' ' SER . 79.7 p -121.75 167.31 13.12 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 107.867 -1.16 . . . . 25.0 107.867 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -146.72 169.95 17.98 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.099 -0.955 . . . . 25.0 109.657 -175.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.23 133.86 42.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 104.302 -2.481 . . . . 25.0 104.302 164.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -112.71 135.69 53.16 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.21 -2.145 . . . . 25.0 105.21 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -116.09 125.04 51.85 Favored 'General case' 0 C--O 1.246 0.873 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 174.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.7 124.86 16.37 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 124.243 0.965 . . . . 25.0 108.988 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 51.63 37.1 19.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.021 0.915 . . . . 25.0 111.186 -174.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 71.37 7.73 64.58 Favored Glycine 0 CA--C 1.543 1.823 0 CA-C-N 115.12 -0.946 . . . . 25.0 115.156 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -108.56 150.67 27.16 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 120.805 -1.409 . . . . 25.0 108.325 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.89 133.88 36.84 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -124.76 149.23 47.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 105.715 -1.957 . . . . 25.0 105.715 171.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -129.13 105.95 8.52 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.803 -1.185 . . . . 25.0 108.09 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.97 175.23 9.73 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 112.743 0.645 . . . . 25.0 112.743 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.583 ' HA ' ' HA ' ' A' ' 22' ' ' SER . 72.7 p -113.08 163.31 14.88 Favored 'General case' 0 C--O 1.206 -1.191 0 O-C-N 123.682 0.614 . . . . 25.0 111.708 177.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.2 88.69 37.96 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 102.136 -3.283 . . . . 25.0 102.136 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -85.09 -66.27 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.139 0 N-CA-C 120.638 3.284 . . . . 25.0 120.638 -167.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.54 117.81 25.55 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.045 -1.659 . . . . 25.0 112.703 -170.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.24 17.91 79.66 Favored Glycine 0 CA--C 1.55 2.273 0 CA-C-O 117.658 -1.634 . . . . 25.0 113.271 174.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 71.1 mt -138.13 153.19 49.26 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 114.785 1.402 . . . . 25.0 114.785 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.82 166.96 18.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -101.4 129.7 47.47 Favored 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.762 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 39.6 t -119.92 112.01 18.66 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 123.222 1.487 . . . . 25.0 109.895 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.02 -23.88 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.935 -1.029 . . . . 25.0 112.455 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.2 p -68.52 -29.89 68.58 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 118.964 -0.541 . . . . 25.0 111.583 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.37 -6.72 22.71 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.5 tptt 59.29 33.65 22.63 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 123.124 1.44 . . . . 25.0 108.963 -177.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 2.6 p -145.89 167.49 23.14 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 113.647 -1.615 . . . . 25.0 113.935 -170.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.1 t -85.79 136.31 33.37 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 115.15 -0.932 . . . . 25.0 109.377 175.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.9 p -131.39 170.64 14.38 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.355 -0.98 . . . . 25.0 108.355 -175.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -76.29 140.15 41.4 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.129 0.972 . . . . 25.0 112.423 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -62.76 -50.29 71.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.952 0.882 . . . . 25.0 111.702 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 155.66 -122.23 1.18 Allowed Glycine 0 C--O 1.242 0.624 0 CA-C-O 121.904 0.724 . . . . 25.0 113.265 -174.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -95.98 161.05 14.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.926 -0.749 . . . . 25.0 111.814 -176.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.1 t -109.74 126.39 29.2 Favored Pre-proline 0 N--CA 1.48 1.068 0 N-CA-C 104.226 -2.509 . . . . 25.0 104.226 176.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -82.15 -11.08 11.12 Favored 'Trans proline' 0 C--O 1.209 -0.95 0 N-CA-C 116.709 1.773 . . . . 25.0 116.709 -173.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 . . . . . 0 CA--C 1.499 -0.988 0 N-CA-C 105.165 -2.161 . . . . 25.0 105.165 -175.49 . . . . . . . . 0 0 . 1 stop_ save_